Publikationen des Jahres 2013

Anorganische und Analytische Chemie

Lehrstuhl für Anorganische Chemie Prof. Dr. Dr. h. c. mult. Wolfgang A. Herrmann (komm. Prof. Dr. Fritz E. Kühn)

Schaper LA, Hock SJ, Herrmann WA, Kühn FE: „Synthese und Anwendung wasserlöslicher NHC-Übergangsmetall-Komplexe“. Angew. Chem. 2013; 125(1): 284–304.Angew. Chem., Int. Ed. 2013; 52(1): 270-289.

Li P, Herrmann WA, Kühn, FE: “Immobilizing Unsaturated NHC Complexes via the Backbone: Synthesis and Application”. ChemCatChem. 2013; 5(11): 3324-3329.

Jantke D, Cokoja M, Pöthig A, Herrmann WA, Kühn FE: “Synthesis and characterization of water-soluble ruthenium(II) and osmium(II) complexes bearing bidentate sulfonated N-heterocyclic carbene ligands”. Organometallics. 2013; 32(3): 741-744.

Hock SJ, Schaper LA, Herrmann WA, Kühn FE: “Group 7 Transition Metal Complexes with N-Heterocyclic”. Chem. Soc. Rev. 2013; 42(12): 5073-5089.

Zhang B, Li S, Pöthig A, Cokoja M, Zang SL, Herrmann WA, Kühn FE: “Oxidation Reactions Catalyzed by Polyoxomolybdate Salts”. Z. Naturforsch. B. 2013; 68(5/6): 587-597.

Herrmann WA: „Tenure Track: Königsweg zur Professur?“. Angew. Chem. 2013; 125(18): 4798-4799. Angew. Chem., Int. Ed. 2013; 52(18): 4700-4701.

Reindl SA, Pöthig A, Drees M, Bechlars B, Herdtweck E, Kühn FE, Herrmann WA: “Pyrazolato-Bridged Dinuclear Complexes of Ru(II) and Rh(III) with N-Heterocyclic Carbenes – Synthesis, Characterization and Electrochemical Properties”. Organometallics. 2013; 32(15): 4082-4091.

Schaper LA, Graser L, Wie X, Zhong R, Öfele K, Pöthig A, Cokoja M, Bechlars B, Herrmann WA, Kühn FE: “Exploring the Scope of a Novel Ligand Class: Synthesis and Catalytic Examination of Metal Com-plexes with ‘Normal’ 1,2,3-Triazolylidene Ligands”. Inorg. Chem. 2013; 52(10): 6142-6152.

Raba A, Anneser MR, Jantke D, Cokoja M, Herrmann WA, Kühn FE: “Facile and Scalable Preparation of 2-Imidazolylpyridines”. Tetrahedron Lett. 2013; 54(26): 3384-3387.

Schaper LA, Wie X, Öfele K, Altmann P, Pöthig A, Drees M, Bechlars B, Herdtweck E, Herrmann WA, Kühn FE: “Synthesis and Comparison of Transition Metal Complexes of ‘Abnormal’ and ‘Normal’ Te-trazolylidenes: a Neglected Ligand Species”. Inorg. Chem. 2013; 52(12): 7031-7044.

Jantke D, Cokoja M, Drees M, Herrmann WA, Kühn FE: “Ruthenium-Catalyzed Hydrogenation of Oxy-gen-Functionalized Aromatic Compounds in Water”. ChemCatChem. 2013; 5(11): 3241-3248.

Schaper LA, Wei X, Hock S, Pöthig A, Öfele K, Cokoja M, Herrmann WA, Kühn FE: “Gold(I) Complexes with ‘Normal’ 1,2,3-Triazolylidene Ligands: Synthesis and Catalytic Properties”. Organometallics. 2013; 32(11): 3376-3384.

Graser LR, Jürgens S, Wilhelm ME, Cokoja M, Herrmann WA, Kühn FE: “Epoxidation of Olefins Cata-lyzed by in-situ Formed Polyoxomolybdates in Ionic Liquids”. Z. Naturforsch. B. 2013; 10(68): 1138-1142.

Cai CM, Höhne D, Köberl M, Cokoja M, Pöthig A, Herdtweck E, Haslinger S, Herrmann WA, Kühn FE: “Synthesis and Characterization of Dimolybdenum(II) Complexes Connected by Carboxylate Linkers”. Organometallics. 2013; 32(20): 6004-6011.

Lee SYT, Ghani AA, D’Elia V, Cokoja M, Drees M, Herrmann WA, Basset JM, Kühn FE: “Liberation of methyl acrylate from metallalactone complexes via M–O ring opening (M = Ni, Pd) with methylation agents”. New J. Chem. 2013; 37(11): 3512-3517.

Herrmann WA: „Zukunftstechnologie Katalyse“. in: 25 Jahre Oxo-Synthese. Editors: Frey G, Dämbkes, G. Ort: Essen. Klartext-Verlagsgesellschaft. 2013: 19-29.

Lehrstuhl für Anorganische Chemie mit Schwerpunkt Neue Materialien Prof. Dr. Thomas F. Fässler

Baran V, Fischer A, Scherer W, Fässler TF: “Synthesis of Large Single Crystals and Thermoelectrical Properties of the Type-I Clathrate K8Zn4Sn42”. Z. anorg. allg. Chem. 2013; 639: 2125-2128.

Benda CB, Schaeper R, Schulz S, Fässler TF: “Synthesis and Crystal Structure of a Salt Containing (1)(∞){Zn-trans-μ(2)(η(3):η(3)-Ge9)}(2-) Anions: A Polymer with Ge9 Zintl Clusters Bridged by Zn Atoms”. Eur. J. Inorg. Chem. 2013; 2013: 5964-5968.

Christensen S, Bjerg L, Kaltzoglou A, Juranyi F, Fässler TF, Unruh T, Christensen M: “Guest host interaction and low energy host structure dynamics in tin clathrates”. J. Appl. Phys. 2013; 113.

Hlukhyy V, Fässler TF: “The New Alkali Cyclotrisilicate Cs8 Si6O16”. Z. anorg. allg. Chem. 2013; 639: 231-233.

Hlukhyy V, Hoffmann AV, Fässler TF: “Synthesis, structure and chemical bonding of CaFe2-xRhxSi2 (x=0, 1.32, and 2) and SrCo2Si2”. J. Solid State Chem. 2013; 203: 232-239.

Hlukhyy V, Siggelkow L, Fässler TF: “From One to Three Dimensions: Corrugated (1)(infinity) NiGe Ribbons as a Building Block in Alkaline Earth Metal Ae/Ni/Ge Phases with Crystal Structure and Chemical Bonding in AeNiGe (Ae = Mg, Sr, Ba)”. Inorg. Chem. 2013; 52: 6905-6915.

Karttunen AJ, Fässler TF: “Structural Principles and Thermoelectric Properties of Polytypic Group 14 Clathrate-II Frameworks”. ChemPhysChem. 2013; 14: 1807-1817.

Stegmaier S, Fässler TF: “Lithium-Stuffed Diamond Polytype Zn-Tt Structures (Tt = Sn, Ge): The Two Lithium-Zinc-Tetrelides Li3Zn2Sn4 and Li2ZnGe3”. Inorg. Chem. 2013; 52: 2809-2816.

Stegmaier S, Kim SJ, Henze A, Fässler TF: “Tetrahedral Framework Structures: Polymorphic Phase Transition with Reorientation of Hexagonal Helical Channels in the Zintl Compound Na2ZnSn5 and Its Relation to Na5Zn2+xSn10-x”. J. Am. Chem. Soc. 2013; 135: 10654-10663.

Waibel M, Fässler TF: “Mixed Si/Ge Nine-Atom Zintl Clusters: ESI Mass Spectrometric Investigations and Single-Crystal Structure Determination of Paramagnetic Si9-xGex(3-)”. Inorg. Chem. 2013; 52: 5861-5866.

Waibel M, Fässler TF: “First Incorporation of the Tetrahedral Sn4(4-) Cluster into a Discrete Solvate Na4Sn4(NH3)(13) from Solutions of Na4Sn4 in Liquid Ammonia”. Z. Naturforsch. B. 2013; 68: 732-734.

Waibel M, Pecher O, Mausolf B, Haarmann F, Fässler TF: “NaRb7(Si4-xGex)2 - Soluble Zintl Phases Containing Heteroatomic Tetrahedral Si4-xGex(4-) Clusters”. Eur. J. Inorg. Chem. 2013; 2013: 5541-5546.

Zeilinger M, Baran V, van Wuellen L, Hässermann U, Fässler TF: “Stabilizing the Phase Li15Si4 through Lithium-Aluminum Substitution in Li15-xAlxSi4 (0.4 < x < 0.8)-Single Crystal X-ray Structure Determination of Li15Si4 and Li14.37Al0.63Si4”. Chem. Mater. 2013; 25: 4113-4121.

Zeilinger M, Benson D, Hässermann U, Fässler TF: “Single Crystal Growth and Thermodynamic Stability of Li17Si4”. Chem. Mater. 2013; 25: 1960-1967.

Zeilinger M, Kurylyshyn IM, Häussermann U, Fässler TF: “Revision of the Li-Si Phase Diagram: Discovery and Single-Crystal X-ray Structure Determination of the High-Temperature Phase Li4.11Si”. Chem. Mater. 2013; 25: 4623-4632.

Zeilinger M, van Wuellen L, Benson D, Kranak VF, Konar S, Fässler TF, Häussermann U: “LiBSi2: A Tetrahedral Semiconductor Framework from Boron and Silicon Atoms Bearing Lithium Atoms in the Channels”. Angew. Chem., Int. Ed. 2013; 52: 5978-5982.

Lehrstuhl für Bauchemie Prof. Dr. Johann Plank

Plank J, Tiemeyer C, Bülichen D, Recalde Lummer N: “A Review of Synergistic and Antagonistic Effects Between Oilwell Cement Additives”. SPE Drilling & Completion. 2013; 28: 398-404.

Habbaba A, Zouaoui N, Plank J: “Synergistic and Antagonistic Effect of SO42- Ions on Dispersing Power of Polycarboxylate”. ACI Materials Journal. 2013; 110: 641-646.

Shafaei S, Lackner M, Meier M, Plank J, Guggenbichler JP, Zollfrank C: “Polymorphs of molybdenum trioxide as innovative antimicrobial materials”. Surface Innovations. 2013; 1: 202-208.

Van Opdenbosch D, Dörrstein J, Klaithong S, Kornprobst T, Plank J, Hietala S, Zollfrank C: “Chemistry and water-repelling properties of phenyl-incorporating wood composites”. Holzforschung. 2013; 67: 931-940.

Song H, Plank J: “Mechanistic Study on the Effect of Sulfate Ions on Polycarboxylate Superplasticizers in Cement”. Advances in Cement Research. 2013; 25: 200-207.

Ng S, Metwalli E, Müller-Buschbaum P, Plank J: “Occurrence of Intercalation of PCE Superplasticizers in Calcium Aluminate Cement under Actual Application Conditions, as evidenced by SAXS Analysis”. Ce-ment and Concrete Research. 2013; 54: 191-198.

Keller H, Plank J: “Mineralisation of CaCO3 in the Presence of Polycarboxylate Comb Polymers”. Ce-ment and Concrete Research. 2013; 54: 1-11.

Salami OT, Plank J: “Preparation and Properties of a Dispersing Fluid Loss Additive Based on Humic Ac-id Graft Copolymer Suitable For Cementing High Temperature (200 °C) Oil Wells”. Journal of Applied Polymer Science. 2013; 129: 2544-2553.

de Reese J, Lenz P, Zilch K, Plank J: “Influence of Type of Superplasticizer and Cement Composition on the Adhesive Bonding between Aged and Fresh Concrete”. Construction & Building Materials. 2013; 48: 717-724.

Klaithong S, Van Opdenbosch D, Zollfrank C, Plank J: “Preparation of CaCO3 and CaO Replicas Retain-ing the Hierarchical Structure of Spruce Wood”. Z. Naturforsch. B. 2013; 68b: 533-538.

Bian H, Plank J: “Effect of Heat Treatment on the Dispersion Performance of Casein Superplasticizer Used in Dry-Mix Mortar”. Cement and Concrete Research. 2013; 51: 1-5.

Bülichen D, Plank J: “Water Retention Capacity and Working Mechanism of Methyl Hydroxypropyl Cellu-lose (MHPC) in Gypsum Plaster – Which Impact has Sulfate?”. Cement and Concrete Research. 2013; 46: 66-72.

Baueregger S, Perello M, Plank J: “Role of PVOH and Kaolin on Colloidal Stability of Liquid and Powder EVA and SB Latexes in Cement Pore Solution”. Colloids Surf., A. 2013; 434: 145-153.

Dubina E, Korat L, Black L, Strupi-Šuput J, Plank J: “Influence of Water Vapour and Carbon Dioxide on Free Lime during Storage at 80 °C, Studied by Raman Spectroscopy”. Spectrochim. Acta Mol. Biomol. Spectros. 2013; 111: 299-303.

Plank J, Lesti M, Tiemeyer C, Echt T: „Beständigkeit von Zementsystemen unter den Bedingungen einer geologischen Endlagerung von CO2 (CCS-Technologie)“. ZKG International. 2013; 66: 28-35.

Bian H, Plank J: “Fractionated and recombined casein superplasticizer in self-leveling underlayments”. Advanced Materials Research. 2013; 687: 443-448.

Pavlitschek T, Gretz M, Plank J: “Effect of Ca2+ Ions on the Film Formation of an Anionic Styrene/n-Butylacrylate Latexpolymer in Cement Pore Solution”. Advanced Materials Research. 2013; 687: 322-328.

Pavlitschek T, Jin Y, Plank J: “Film Formation of a Non-Ionic Ethylene-Vinyl Acetate Latex Dispersion in Cement Pore Solution”. Advanced Materials Research. 2013; 687: 316-321.

Pavlitschek T, Gretz M, Plank J: “Novel Core-Shell Hybrid Polymers Designed as Dual Functional Addi-tives for Concrete”. Advanced Materials Research. 2013; 687: 77-83.

Habbaba A, Lange A, Plank J: “Synthesis and Performance of a Modified Polycarboxylate Dispersant for Concrete Possessing Enhanced Cement Compatibility”. Journal of Applied Polymer Science. 2013; 129: 346-353.

Tiemeyer C, Plank J: “Synthesis, Characterisation and Working Mechanism of a Synthetic High Temper-ature (200 °C) Fluid Loss Polymer For Oil Well Cementing Containing Allyloxy-2-hydroxy Propane Sul-fonic Acid Monomer”. Journal of Applied Polymer Science. 2013; 128: 851-860.

Whittaker M, Dubina E, Al-Mutawa F, Arkless L, Plank J, Black L: “The effect of prehydration on the en-gineering properties of CEM I Portland cement”. Advances in Cement Research. 2013; 25: 12-20.

Lesti M, Tiemeyer C, Plank J: “CO2 Stability of Portland Cement Based Well Cementing Systems For Use on Carbon Capture & Storage (CCS) Wells”. Cement and Concrete Research. 2013; 45: 45-54.

Pavlitschek T, Gretz M, Plank J: “Microcapsules prepared from polycondensate-based cement super-plasticizers via layer-by-layer self assembly on melamine-formaldehyde core templates”. Journal of Ap-plied Polymer Science. 2013; 127: 3705-3711.

Kornprobst T, Plank J: “Synthesis and Properties of Magnesium Carbonate Xerogels and Aerogels”. Journal of Non-Crystalline Solids. 2013; 361: 100-105.

Fachgebiet Analytische Chemie Prof. Dr. Michael Schuster

Lingxiangyu L, Leopold K, Schuster M: “Comparative study of alkylthiols and alkylamines for the phase transfer of gold nanoparticles from an aqueous phase to n-hexane”. J. Colloid Interface Sci. 2013; 397: 199-205.

Lingxiangyu L, Hartmann G, Doeblinger M et al.: “Quantification of Nanoscale Silver Particles Removal and Release from Municipal Wastewater Treatment Plants in Germany”. Environ. Sci. Technol. 2013; 47: 7317-7323.

Hartmann G, Schuster M: “Species selective preconcentration and quantification of gold nanoparticles using cloud point extraction and electrothermal atomic absorption spectrometry”. Anal. Chim. Acta. 2013; 761: 27-33.

Hartmann G, Hutterer C, Schuster M: “Ultra-trace determination of silver nanoparticles in water samples using cloud point extraction and ETAAS”. J. Anal. At. Spectrom. 2013; 28(4): 567-572.

Fachgebiet Anorganische Chemie Prof. Dr. Klaus Köhler

Haessner C, Mueller B, Storcheva O, et al.: “Isolated Vanadium Surface Complexes on Aluminum Fluo-ride - A Model for the Relevance of Oxygen Atoms of Aluminum Oxide Supports in Catalytic Oxidation Reactions”. ChemCatChem. 2013; 5: 3260-3268.

Behrens M, Lolli G, Muratova N, et al.: “The effect of Al-doping on ZnO nanoparticles applied as catalyst support”. Phys. Chem. Chem. Phys. 2013, 15: 1374-1381.

Fachgebiet Molekulare Katalyse Prof. Dr. Fritz E. Kühn

Yeong HY, Li Y, Kühn FE, Voit B: “The Role of Solvent Ligated Metal (II) Complexes Incorporating (Fluoroalkoxy)aluminates as Weakly Coordinating Anions in Isobutylene Polymerization”. J. Polym. Sci. Pol. Chem. 2013; 51: 158-157.

Schaper LA, Hock SJ, Herrmann WA, Kühn FE: “Synthesis and Applications of Water Soluble NHC Tran-sition Metal Complexes”. Angew. Chem. 2013; 125: 284-304.

Angew. Chem., Int. Ed. 2013; 52: 270-289.

Michel T, Cokoja M, Kühn FE: “Catalytic Epoxidation of Camphene Using Methyltrioxorhenium(VII) as Catalyst”. J. Mol. Catal. A: Chem. 2013; 368: 145-151.

Müller C, Grover N, Cokoja M, Kühn FE: “Homogeneous Catalytic Olefin Epoxidation with Molybdenum Complexes”. Adv. Inorg. Chem. 2013; 65: 33-83.

Huber S, Cokoja M, Drees M, Mink J, Herrmann WA, Kühn FE: “Xylytrioxorhenium – the first arylrheni-um(VII) oxide applicable as an olefin epoxidation catalyst”. Catal. Sci. Technol. 2013; 3: 388-393.

Delhomme D, Schaper LA, Zhang-Preße M, Raudaschl-Sieber G, Weuster-Botz D, Kühn FE: “Catalytic hydrogenation of levulinic acid in aqueous phase” J. Organomet. Chem. 2013; 724: 297-299.

Kühn FE: “Catalysis”. Angew. Chem. 2013; 52: 2.

Jantke D, Cokoja M, Pöthig A, Herrmann WA, Kühn FE: “Synthesis and characterization of water-soluble ruthenium(II) and osmium(II) complexes bearing bidentate sulfonated N-heterocyclic carbene ligands”. Organometallics. 2013; 32(3): 741-744.

Hauser SA, Cokoja M, Kühn FE: “Epoxidation of olefins with homogeneous catalysts – Quo vadis?” Catal. Sci. Technol. 2013; 3: 552-561.

Bruno SM, Pillinger M, Kühn FE, Goncalves IS, Valente AA: “Isomerization of α-pinene oxide in the pres-ence of methyltrioxorhenium(VII)”. Catal. Comm. 2013; 35: 40-44.

Fischer CE, Mink J, Hajba L, Bacsik Z, Nemeth C, Mihaly J, Raith A, Cokoja M, Kühn FE: “Vibrational Spectroscopy Studay of SiO2-based Nanotubes”. Vibrational Spectroscopy. 2013; 66: 104-118.

Markovits IIE, Eger AA, Yue S, Cokoja M, Münchmeyer CJ, Zhang B, Zhou MD, Genest A, Mink J, Zang SL, Rösch N, Kühn FE: “Activation of hydrogen peroxide with ionic liquids: mechanistic studies and ap-plication in the epoxidation of olefins”. Chem. Eur. J. 2013; 19: 5972-5979.

Korinth V, Kühn FE: “Encyclopedia of Reagents für Organic Synthesis, Online”. e-Eros, L. A. Paquette (Hrsg.), John Wiley & Sons Ltd., www.mrw.interscience.wiley.com/eros/ 2013; 2-4 (Bathophenanthroline – First Update).

Li S, Zhang B, Kühn FE: “Benzimidazolic Complexes of Methyltrioxorhenium(VII): Synthesis and Applica-tion in Catalytic Olefin Epoxidation”. J. Organomet. Chem. 2013; 730: 132-136.

Schaper LA, Graser L, Wie X, Zhong R, Öfele K, Pöthig A, Cokoja M, Bechlars B, Herrmann WA, Kühn FE: “Exploring the Scope of a Novel Ligand Class: Synthesis and Catalytic Examination of Metal Com-plexes with ‘Normal’ 1,2,3-Triazolylidene Ligands”. Inorg. Chem. 2013; 52(10): 6142-6152.

Zhang B, Li S, Herdtweck E, Kühn FE: “Schiff Base Complexes of Methyltrioxorhenium(VII): Synthesis and Catalytic Application”. J. Organomet. Chem. 2013; 739: 63-68.

Hock SJ, Schaper LA, Herrmann WA, Kühn FE: “Group 7 Transition Metal Complexes with N-Heterocyclic”. Chem. Soc. Rev. 2013; 42(12): 5073-5089.

Monassier A, D’Elia V, Cokoja M, Dong H, Pelletier JDA, Basset JM, Kühn FE: “Synthesis of Cyclic Car-bonates from Epoxide and CO2 under Mild Conditions Using a Simple, Highly Efficient Niobium-Based Catalyst”. ChemCatChem. 2013; 5: 1321-1324.

Raba A, Anneser MR, Jantke D, Cokoja M, Herrmann WA, Kühn FE: “Facile and Scalable Preparation of 2-Imidazolylpyridines”. Tetrahedron Lett. 2013; 54(26): 3384-3387.

Schaper LA, Wie X, Öfele K, Altmann P, Pöthig A, Drees M, Bechlars B, Herdtweck E, Herrmann WA, Kühn FE: “Synthesis and Comparison of Transition Metal Complexes of ‘Abnormal’ and ‘Normal’ Te-trazolylidenes: a Neglected Ligand Species”. Inorg. Chem. 2013; 52(12): 7031-7044.

Zhang B, Li S, Pöthig A, Cokoja M, Zang SL, Herrmann WA, Kühn FE: “Oxidation Reactions Catalyzed by Polyoxomolybdate Salts”. Z. Naturforsch. B. 2013; 68(5/6): 587-597.

Yue S, Fang DW, Li J, Zang SL, Zhou MD, Zhang B, Markovits IIE, Cokoja M, Kühn FE: “Synthesis and Characterization of Ionic Liquid Imidazolium Perrhenates”. Z. Naturforsch. B. 2013; 68b: 598-604.

Schaper LA, Wei X, Hock S, Pöthig A, Öfele K, Cokoja M, Herrmann WA, Kühn FE: “Gold(I) Complexes with ‘Normal’ 1,2,3-Triazolylidene Ligands: Synthesis and Catalytic Properties”. Organometallics. 2013; 32(11): 3376-3384.

Witt J, Pöthig A, Kühn FE, Baratta W: “Abnormal N-Heterocyclic Carbene-Phosphine Ruthenium(II) Complexes as Active Catalysts for Transfer Hydrogenation”. Organometallics. 2013; 32: 4042-4045.

Reindl SA, Pöthig A, Drees M, Bechlars B, Herdtweck E, Kühn FE, Herrmann WA: “Pyrazolato-Bridged Dinuclear Complexes of Ru(II) and Rh(III) with N-Heterocyclic Carbenes – Synthesis, Characterization and Electrochemical Properties”. Organometallics. 2013; 32(15): 4082-4091.

Kühn FE: „Wolfgang A. Herrmann“. J. Organomet. Chem. 2013; 744: 1-2.

Zhang B, Li S, Yue S, Cokoja M, Zhou MD, Zhang SL, Kühn FE: “Imidazolium perrhenate ionic liquids as efficient catalysts for the selective oxidation of sulphides to sulfones”. J. Organomet. Chem. 2013; 744: 108-112.

Lee SYT, Ghani AA, D’Elia V, Cokoja M, Drees M, Herrmann WA, Basset JM, Kühn FE: “Liberation of methyl acrylate from metallalactone complexes via M–O ring opening (M = Ni, Pd) with methylation agents”. New J. Chem. 2013; 37(11): 3512-3517.

Li P, Herrmann WA, Kühn FE: “Unsaturated NHC Complexes Immobilized via the Backbone: Synthesis and Application”. ChemCatChem. 2013; 5: 3324-3329.

Jantke D, Cokoja M, Drees M, Herrmann WA, Kühn FE: “Ruthenium-Catalyzed Hydrogenation of Oxy-gen-Functionalized Aromatic Compounds in Water”. ChemCatChem. 2013; 5(11): 3241-3248.

Ziriakus J, Zimmermann TK, Pöthig A, Drees M, Haslinger S, Jantke D, Kühn FE: “Ruthenium Catalysed Transvinylation – New Insights”. Adv. Synth. Catal. 2013; 355: 2845-2859.

Cai CM, Höhne D, Köberl M, Cokoja M, Pöthig A, Herdtweck E, Haslinger S, Herrmann WA, Kühn FE: “Synthesis and Characterization of Dimolybdenum(II) Complexes Connected by Carboxylate Linkers”. Organometallics. 2013; 32(20): 6004-6011.

Drees M, Hauser SA, Cokoja M, Kühn FE: “DFT studies on the reaction pathway of the catalytic olefin epoxidation with CoMoCF3 dioxo and oxo-peroxo complexes”. J. Organomet. Chem. 2013; 748: 36-45.

Graser LR, Jürgens S, Wilhelm ME, Cokoja M, Herrmann WA, Kühn FE: “Epoxidation of Olefins Cata-lyzed by in-situ Formed Polyoxomolybdates in Ionic Liquids”. Z. Naturforsch. B. 2013; 10(68): 1138-1142.

Müller C, Cokoja M, Kühn FE: “Chapter 2.1.1, Modern cariants of Wittig, Tebbe, Peterson protocols”. Science of Synthesis. Stuttgart: Thieme Verlag. 2013: 1-29.

Möller M, Witt J, Cokoja M, Kühn FE: “Chapter 2.5.5, Reaction of Formaldehyde with Organometallic Reagents” Science of Synthesis. Stuttgart: Thieme Verlag. 2013: 289-309.

Fachgebiet Strukturanalytik in der Katalyse Prof. Dr. Moniek Tromp

Bartlett SA, Cibin G, Dent AJ, Evans J, Hanton MJ, Reid G, Tooze RP, Tromp M: “Sc(III) complexes with neutral N3- and SNS-donor ligands – a spectroscopic study of the activation of ethene polymerisation catalyst”. Dalton Trans. 2013; 42: 2213-2223.

Tromp M, Dent AJ, Headspith J, Eason TL, Sun XZ, George MW, Mathon O, Smolentsev G, Hamilton MA, Evans J: “Energy Dispersive XAFS: Characterisation of Electronically Excited States of Cu(I) Com-plexes”. J. Phys. Chem. B. 2013; 117(24): 7381-7387.

Kas J, Rehr J, Tromp M, Thomas RJ, Glatzel P: “Real Space Green's Function Approach to Resonant Inelastic X-Ray Scattering and HERFD XAS”. J. of Phys.: Conf. Series. 2013; 430: 012003.

Keltie SM, Gale PA, Light ME, Tromp M: “A linear rod-packing coordination polymer constructed from a non-linear dicarboxylate and the [Zn4O]6+ cluster”. J. Coord. Chem. 2013; 66(17): 3058-3062.

Kroner A, Newton MA, Tromp M, Russell AE, Dent AJ, Evans J: “Structural characterisation of alumina supported Rh catalysts: Effects of ceriation and zirconation by metalorganic precursors”. Chem-PhysChem. 2013; 41(14): 3606-3617.

Kapdi A, Naik M, Pednekar S, Karbelkar A, Fischer C, Schulzke C, Tromp M: “Efficient synthesis of coumarin-based Tetra and pentacyclic rings using Phospha-Palladacycles”. R. Soc. Chem. Adv. 2013; 3: 20905-20912.

Frenkel A, Small MW, Smith JG, Nuzzo RG, Kvashnina KO, Tromp M: “An In-Situ Study of Bond Strains in 1nm Pt Catalysts and their Sensitivities to Cluster-Support and Cluster-Adsorbate Interactions”, J. Phys. Chem. C. 2013; 117(44): 23286-23294.

Fachgebiet Synthese und Charakterisierung Innovativer Materialien Prof. Dr. Tom Nilges

Stan MC, von Zamory J, Passerini ST, Nilges T, Winter M: “Puzzling out the origin of the electrochemical activity of black P as negative electrode material with lithium for Lithium-ion batteries”. J. Mater. Chem. A. 2013; 1: 5293-5300.

Osters O, Blazek G, Nilges T: “The unlikely truth about Peiers-distorted In chains in In4Se3-x”. Z. anorg. allg. Chem. 2013; 639: 497-501.

Schürmann U, Duppel V, Nilges T, Britvin S, Kovalenker VA, Kienle L: “From Chalcogenides to Polychal-cogenidehalides – First Identification in Mineral Samples”. Z. anorg. allg. Chem. 2013; 639: 2761-2763.

Eckstein N, Hohmann A, Nilges T, Schmidt P: “Synthesis and Phase Relations of Single-Phase Fibrous Phosphorus”. Z. anorg. allg. Chem. 2013; 639: 2741-2743.

Giller M, Bawohl M, Gerstle AP, Nilges T: “Copper substitution and mixed cation effect in Ag10Te4Br3”. Z. anorg. allg. Chem. 2013; 639: 2379-2381.

Greiwe M, Krause M, Osters O, Dorantes A, Piana M, Nilges T: “Zirconium Transition Metal (Poly)antimonides – Syntheses, Characterization and Electrochemical Properties”. Z. Naturforsch. B. 2013; 68: 979-986.

Bawohl M, Schmidt P, Nilges T: “Temperature initiated P-polymerization in solid [Cd3Cu]CuP10”. Inorg. Chem. 2013; 52: 11895-11901.

Arbeitsgruppe Fluorchemie PD Dr. Florian Kraus

Scherf LM, Baer SA, Kraus F, Bawaked SM, Schmidbaur H: “Implications of the crystal structure of the ammonia solvate [Au(NH3)2]Cl ∙ 4 NH3”. Inorg. Chem. 2013; 52: 2157-2161.

Adelhelm P, Armbrüster M, Kraus F: „Trendbericht Festkörperchemie“. Nachr. Chem. 2013; 61: 252-264.

Kraus F, Panda M, Müller T, Albert B: “Closo-Hydroborates from liquid Ammonia: Synthesis and Crystal Structures of [Li(NH3)4]2[B12H12]∙2NH3, Rb2[B12H12]∙8NH3, Cs2[B12H12]∙6NH3 and Rb2[B10H10]∙5NH3”. Inorg. Chem. 2013; 52: 4692-4699.

Kraus F, Baer SA, Hoelzel M, Karttunen AJ: “[Be(ND3)4]Cl2: Synthesis, Characterization, and Space Group Determination guided by Solid-State Quantum Chemical Calculations”. Eur. J. Inorg. Chem. 2013, 4184-4190.

Ivlev S, Woidy P, Kraus F, Gerin I, Ostvald R: “Tetrafluorobromates for Urban Mining of Noble Metals – A Case Study on Iridium Metal”. Eur. J. Inorg. Chem. 2013; 4984-4987.

Jantke D, Marziale AN, Reiner T, Kraus F, Herdtweck E, Raba A, Eppinger J: “Synthetic strategies for ef-ficient conjugation of organometallic complexes with pendant protein reactive markers”. J. Organomet. Chem. 2013; 744: 82-91.

Hinteregger E, Wurst K, Perfler L, Kraus F, Huppertz H: “High-pressure Synthesis and Characterization of the Actinide Borate-Phosphate U2[BO4][PO4]”. Eur. J. Inorg. Chem. 2013; 5247-5252.

Kraus F, Schmidbaur H, Bawaked SW: “Tracing Hydrogen Bonding Au∙∙∙H−C at Gold Atoms: A Case

Study”. Inorg. Chem. 2013; 52: 9669-9674.

Ivlev S, Woidy P, Sobolev V, Gerin I, Ostvald R, Kraus F: “On Tetrafluorobromates(III): Crystal Structures of the Dibromate CsBr2F7 and the Monobromate CsBrF4”. Z. anorg. allg. Chem. 2013; 639: 2846-2850.

Baer SA, Lozinšek M, Kraus F: “Synthesis and Crystal Structure of Triammine Pentafluorido Tantalum(V) [TaF5(NH3)3]”. Z. anorg. allg. Chem. 2013; 639: 2586-2588.

Hinteregger E, Hofer TS, Heymann G, Perfler L, Kraus F, Huppertz H: “High-pressure Synthesis and Characterization of the new Actinide Borates AnB4O8 (An = Th, U)”. Chem. Eur. J. 2013; 19: 15985-15992.

Woidy P, Kraus F: “The Diammine Silver(I) Acetate [Ag(NH3)2]OAc”. Z. anorg. allg. Chem. 2013; 639: 2643-2647.

Baer SA, Pöthig A, Bawaked SM, Schmidbaur H, Kraus F: “Bis(triphenylphosphine)gold(I) Perrhenate”. Z. Naturforsch. B. 2013; 68b: 1173-1179.

Schmidbaur H, Blumenthal MA, Kraus F: “Synthesis of a Tri(gold)boride Complex (Cy3P)B[AuP(o-Tol)3]3”. Z. Naturforsch. B. 2013; 68b: 1321-1326.

Organische Chemie und Biochemie

Lehrstuhl für Biochemie Prof. Dr. Michael Groll, Prof. Dr. Wolfgang Eisenreich, Dr. Sabine Schneider

Kunfermann A, Lienau C, Illarionov B, Held J, Gräwert T, Behrendt C, Werner P, Hähn S, Eisenreich W, Riederer U, Mordmüller B, Bacher A, Fischer M, Groll M, Kurz T: “IspC as Target for Antiinfective Drug Discovery: Synthesis, Enantiomeric Separation, and Structural Biology of Fosmidomycin Thia Isosters”. J. Med. Chem. 2013; 56(20): 8151-8162.

Zeiler E, List A, Alte F, Gersch M, Wachtel R, Poreba M, Drag M, Groll M, Sieber SA: “Structural and functional insights into caseinolytic proteases reveal an unprecedented regulation principle of their cata-lytic triad”. Proc. Natl. Acad. Sci. USA. 2013; 110(28): 11302-11307.

Müller R, Gräwert MA, Kern T, Madl T, Peschek J, Sattler M, Groll M, Buchner J: “High-resolution struc-tures of the IgM Fc domains reveal principles of its hexamer formation”. Proc. Natl. Acad. Sci. USA. 2013; 110(25): 10183-10188.

Quitterer F, Beck P, Bacher A, Groll M: “Structure and reaction mechanism of pyrrolysine synthase (PylD)”. Angew. Chem., Int. Ed. 2013; 52(27): 7033-7037.

Span I, Wang K, Wang W, Jauch J, Eisenreich W, Bacher A, Oldfield E, Groll M: “Structures of Fluoro, Amino and Thiol Inhibitors Bound to the [Fe4S4] Protein IspH”. Angew. Chem., Int. Ed. 2013; 52(7): 2118-2121.

Kawamura S, Unno Y, List A, Sasaki T, Tanaka M, Arisawa M, Asai A, Groll M, Shuto S: “Potent Pro-teasome Inhibitors Derived from the Unnatural Cis-Cyclopropane Isomer of Belactosin A: Synthesis, Bio-logical Activity, and Mode of Action”. J. Med. Chem. 2013; 56(9): 3689-700.

Desvergne A, Genin E, Marechal X, Gallastegui N, Dufau L, Richy N, Groll M, Vidal J, Reboud-Ravaux M: “Dimerized Linear Mimics of a Natural Cyclopeptide (TMC-95A) Are Potent Noncovalent Inhibitors of the Eukaryotic 20S Proteasome”. J. Med. Chem. 2013; 56(8): 3367-3378.

Geurink PP, van der Linden WA, Mirabella AC, Gallastegui N, de Bruin G, Blom AE, Voges MJ, Mock ED, Florea BI, van der Marel GA, Driessen C, van der Stelt M, Groll M, Overkleeft HS, Kisselev AF: “Incorpo-ration of non-natural amino acids improves cell permeability and potency of specific inhibitors of pro-teasome trypsin-like sites”. J. Med. Chem. 2013; 56(3): 1262-1275.

Hartmann T, Zhang B, Baronian G, Schulthess B, Homerova D, Grubmüller S, Kutzner E, Gaupp R, Ber-tram R, Powers R, Eisenreich W, Kormanec J, Herrmann M, Molle V, Somerville GA, Bischoff M: “Cata-bolite control protein E (CcpE) is a LysR-type transcriptional regulator of tricarboxylic acid cycle activity in Staphylococcus aureus”. J. Biol. Chem. 2013; 288: 36116-36128.

Brzuszkiewicz E, Schulz T, Rydzewski K, Daniel R, Gillmaier N, Dittmann C, Holland G, Schunder E, Lautner M, Eisenreich W, Lück C, Heuner K: “Legionella oakridgensis ATCC 33761 genome sequence and phenotypic characterization reveals its replication capacity in amoebae”. Int. J. Med. Microbiol. 2013; 303(8): 514-528.

Knispel N, Ostrozhenkova E, Schramek N, Huber C, Peña-Rodríguez LM, Bonfill M, Palazón J, Wisch-mann G, Cusidó RM, Eisenreich W: “Biosynthesis of panaxynol and panaxydol in Panax ginseng”. Mole-cules. 2013; 18(7): 7686-7698.

Eisenreich W, Heesemann J, Rudel T, Goebel W: “Metabolic host responses to infection by intracellular bacterial pathogens”. Front. Cell. Infect. Microbiol. 2013; 3: 24.

Ahmed Z, Zeeshan S, Huber C, Hensel M, Schomburg D, Münch R, Eisenreich W, Dandekar T: “Soft-ware LS-MIDA for efficient mass isotopomer distribution analysis in metabolic modelling”. BMC Bioin-formatics. 2013; 14: 218.

Polzin S, Huber C, Eylert E, Elsenhans I, Eisenreich W, Schmidt H: “Growth media simulating ileal and colonic environments affect the intracellular proteome and carbon fluxes of enterohemorrhagic Esche-richia coli O157:H7 strain EDL933”. Appl. Environ. Microbiol. 2013; 79(12): 3703-3715.

Spielbauer G, Li L, Römisch-Margl L, Do PT, Fouquet R, Fernie AR, Eisenreich W, Gierl A, Settles AM: “Chloroplast-localized 6-phosphogluconate dehydrogenase is critical for maize endosperm starch ac-cumulation”. J. Exp. Bot. 2013; 64(8): 2231-2242.

Nörenberg S, Reichardt B, Andelfinger V, Eisenreich W, Engel KH: “Influence of the stereochemistry on the sensory properties of 4-mercapto-2-heptanol and its acetyl-derivatives”. J. Agric. Food Chem. 2013; 61(9): 2062-2069.

Heuner K, Eisenreich W: “The intracellular metabolism of legionella by isotopologue profiling”. Methods Mol. Biol. 2013; 954: 163-181.

Görner C, Häuslein I, Schrepfer P, Eisenreich W, Brück T: “Targeted engineering of cyclooctat-9-en-7-ol synthase: A stereospecific access to two new non-natural fusicoccane-type diterpenes”. Chem-CatChem. 2013; 5: 3289-3298.

Eisenreich W, Huber C, Kutzner E, Knispel N, Schramek N: “Towards a better understanding of metabol-ic pathways”. In: Handbook of Plant Metabolomics. Editors: Weckwerth W, Kahl G. New York: Wiley-Blackwell, 2013: 25-56.

Schneider S, Gattner MJ, Vrabel M, Flügel V, López-Carrillo V, Prill S, Carell T: “Structural Insights into Incorporation of Norbornene Amino Acids for Click Modification of Proteins”. ChemBioChem. 2013; 14: 2114-2118.

Lehrstuhl für Biotechnologie Prof. Dr. Johannes Buchner, Dr. Jeannette Winter

Kayser J, Haslbeck M, Dempfle L, Krause M, Grashoff C, Buchner J, Herrmann H, Bausch AR: “The small heat shock protein Hsp27 affects assembly dynamics and structure of keratin intermediate fila-ment networks”. Biophysical Journal. 2013; 8: 1778-1785.

Bertz M, Buchner J, Rief M: “Mechanical stability of the antibody domain C(H)3 homodimer in different oxidation states”. J. Am. Chem. Soc. 2013; 40: 15085-15091.

Peschek J, Braun N, Rohrberg J, Back KC, Kriehuber T, Kastenmüller A, Weinkauf S, Buchner J: “Regulated structural transitions unleash the chaperone activity of alpha B-crystallin”. Proc. Natl. Acad. Sci. USA. 2013; 40: E3780-E3789.

Beebe K, Mollapour M, Scroggins B, Prodromou C, Xu W, Tokita M, Taldone T, Pullen L, Zierer BK, Lee MJ, Trepel J, Buchner J, Bolon D, Chiosis G, Neckers L: “Post-translational modification and conforma-tional state of heat shock protein 90 differentially affect binding of chemically diverse small molecule in-hibitors”. Oncotarget. 2013; 7: 1065-1074.

Hendershot LM, Feige MJ, Buchner J: “Acidification activates ERp44-a molecular litmus test for protein assembly”. Mol. Cell. 2013; 6: 779-781.

Müller R, Gräwert MA, Kern T, Madl T, Peschek J, Sattler M, Groll M, Buchner J: “High-resolution struc-tures of the IgM Fc domains reveal principles of its hexamer formation”. Proc. Natl. Acad. Sci. USA. 2013; 25: 10183-10188.

Roehl A, Rohrberg J, Buchner J: “The chaperone Hsp90: changing partners for demanding clients”. Trends Biochem. Sci. 2013; 5: 253-262.

Li J, Zoldak G, Kriehuber T, Soroka J, Schmid FX, Richter K, Buchner J: “Unique proline-rich domain regulates the chaperone function of AIPL1”. Biochemistry. 2013; 12: 2089-2096.

Li J, Richter K, Reinstein J, Buchner J: “Integration of the accelerator Aha1 in the Hsp90 co-chaperone cycle”. Nat. Struct. Mol. Biol. 2013; 3: 326-331.

Marcinowski M, Rosam M, Seitz C, Elferich J, Behnke J, Bello C, Feige MJ, Becker CF, Antes I, Buchner J: “Conformational selection in substrate recognition by Hsp70 chaperones”. J. Mol. Biol. 2013; 3: 466-474.

Kateb F, Perrin H, Tripsianes K, Zou P, Spadaccini R, Bottomley M, Franzmann TM, Buchner J, Ansieau S, Sattler M: “Structural and functional analysis of the DEAF-1 and BS69 MYND domains”. PLOS ONE. 2013; 1: e54715.

Retzlaff M, Rohrberg J, Küpper NJ, Lagleder S, Bepperling A, Manzenrieder F, Peschek J, Kessler H, Buchner J: “The regulatory domain stabilizes the p53 tetramer by intersubunit contacts with the DNA binding domain”. J. Mol. Biol. 2013; 1: 144-155.

Li, J, Buchner J: “Structure, function and regulation of the Hsp90 machinery”. Biomed. J. 2013; 36: 106-117.

Drazic A, Tsoutsoulopoulos A, Peschek J, Gundlach J, Krause M, Bach NC, Gebendorfer KM, Winter J: “Role of cysteines in the stability and DNA-binding activity of the hypochlorite-specific transcription fac-tor HypT”. PLOS ONE. 2013; 8: e75683.

Drazic A, Miura H, Peschek J, Le Y, Bach NC, Kriehuber T, Winter J: “Methionine oxidation activates a transcription factor in response to oxidative stress”. Proc. Natl. Acad. Sci. USA. 2013; 110: 9493-9498.

Lehrstuhl für Biomolekulare NMR-Spektroskopie Prof. Dr. Michael Sattler, PD Dr. Sonja A. Dames, Dr. Oliver Lange, Dr. Tobias Madl

Kang C, Ye H, Chia J, Choi BH, Dhe-Paganon S, Simon B, Schutz U, Sattler M, Yoon HS: “Functional role of the flexible N-terminal extension of FKBP38 in catalysis”. Sci. Rep. 2013; 3: 2985.

Pfaff J, Hennig J, Herzog F, Aebersold R, Sattler M, Niessing D, Meister G: “Structural features of Argonaute-GW182 protein interactions”. Proc. Natl. Acad. Sci. USA. 2013; 110(40): E3770-E3779.

Dallmann A, Simon B, Duszczyk MM, Kooshapur H, Pardi A, Bermel W, Sattler M: “Efficient Detection of Hydrogen Bonds in Dynamic Regions of RNA by Sensitivity-Optimized NMR Pulse Sequences”. Angew. Chem., Int. Ed. 2013; 52(40): 10487-10490.

Zeitler B, Herrera Diaz A, Dangel A, Thellmann M, Meyer H, Sattler M, Lindermayr C: “De-novo design of antimicrobial peptides for plant protection”. PLOS ONE. 2013; 8: e71687.

Müller R, Gräwert MA, Kern T, Madl T, Peschek J, Sattler M, Groll M, Buchner J: “High-resolution structures of the IgM Fc domains reveal principles of its hexamer formation”. Proc. Natl. Acad. Sci. USA. 2013; 110: 10183-10188.

Kadam RU, Garg D, Schwartz J, Visini R, Sattler M, Stocker A, Darbre T, Reymond JL: “CH-pi "T-Shape" Interaction with Histidine Explains Binding of Aromatic Galactosides to Pseudomonas aeruginosa Lectin LecA”. ACS Chem. Biol. 2013; 8(9):1925-1930.

Hennig J, Wang I, Sonntag M, Gabel F, Sattler M: “Combining NMR and small angle X-ray and neutron scattering in the structural analysis of a ternary protein-RNA complex”. J. Biomol. NMR. 2013; 56(1): 17-30.

Graber M, Hell M, Grost C, Friberg A, Sperl B, Sattler M, Berg T: “Oral disinfectants inhibit protein-protein interactions mediated by the anti-apoptotic protein Bcl-xL and induce apoptosis in human oral tumor cells”. Angew. Chem., Int. Ed. 2013; 52: 4487-4491.

Garg D, Beribisky AV, Ponterini G, Ligabue A, Marverti G, Martello A, Costi MP, Sattler M, Wade RC: “Translational repression of thymidylate synthase by targeting its mRNA”. Nucleic Acids Res. 2013; 41(7): 4159-4170.

Kateb F, Perrin H, Tripsianes K, Zou P, Spadaccini R, Bottomley M, Franzmann TM, Buchner J, Ansieau S, Sattler M: “Structural and Functional Analysis of the DEAF-1 and BS69 MYND Domains”. PLOS ONE. 2013; 8: e54715.

Zhang Y, Madl T, Bagdiul I, Kern T, Kang HS, Zou P, Mausbacher N, Sieber SA, Kramer A, Sattler M: “Structure, phosphorylation and U2AF65 binding of the N-terminal domain of splicing factor 1 during 3'-splice site recognition”. Nucleic Acids Res. 2013; 41: 1343-1354.

Zeitler B, Bernhard A, Meyer H, Sattler M, Koop HU, Lindermayr C: “Production of a de-novo designed antimicrobial peptide in Nicotiana benthamiana”. Plant Mol. Biol. 2013; 81: 259-272.

Sommer LAM, Schaad M, Dames SA: “NMR- and CD-Monitored Lipid-Binding Studies Suggest a Gen-eral Role for the FATC Domain as Membrane Anchor of Phosphatidyl-Inositol-3 Kinase-Related Kinases (PIKKs)”. J. Biol. Chem. 2013; 288(27): 20046-20063.

van der Schot G, Zhang Z, Vernon R, Shen Y, Vranken WF, Baker D, et al.: “Improving 3D structure pre-diction from chemical shift data”. J. Biomol. NMR. 2013; 57: 27-35.

Vernon R, Shen Y, Baker D, Lange, OF: “Improved chemical shift based fragment selection for CS-Rosetta using Rosetta3 fragment picker”. J. Biomol. NMR. 2013; 57: 117-127.

Zhang Z, Lange, OF: “Replica Exchange Improves Sampling in Low-Resolution Docking Stage of Ro-settaDock”. PLOS ONE. 2013; 8: e72096.

Hocking HG, Zangger K, Madl T: “Studying structure and dynamics of biomolecules using soluble para-magnetic probes”. ChemPhysChem. 2013; 14: 3082-3094.

Putker M, Madl T, Vos HR, de Ruiter H, Visscher M, van den Berg MCW, Kaplan M, Korswagen HC, Boelens R, Vermeulen M, Burgering BMT, Dansen TB: “Redox-dependent control of FOXO/DAF-16 by transportin-1”. Mol. Cell. 2013; 49: 730-742.

Lehrstuhl für Organische Chemie I Prof. Dr. Thorsten Bach, Prof. Dr. Stefan M. Huber, Prof. Dr. Konrad Tiefenbacher

Maturi MM, Wenninger M, Alonso R, Bauer A, Pöthig A, Riedle E, Bach T: “Intramolecular [2+2] Photo-cycloaddition of 3- and 4-(But-3-enyl)oxyquinolones:Influence of the Alkene Substitution Pattern, Phot-physical Studies and Enantioselective Catalysis by a Chiral Sensitizer”. Chem. Eur. J. 2013; 19: 7461-7472.

Fort DA, Woltering TJ, Nettekoven M, Knust H, Bach T: “Conformationally restricted pyrrolidines by in-tramolecular [2+2] photocycloaddition reactions”. Chem. Commun. 2013; 49: 2899-2991.

Jiao L, Bach T: “Palladium-Catalyzed Direct C-H Alkylation of Electron-Deficient Pyrrole Derivatives”. Angew. Chem., Int. Ed. 2013; 52: 6080-6083.

Angew. Chem. 2013; 125: 6196-6199.

Schnapperelle I, Bach T: “C4-Selective Oxidative Coupling of Thiophenes with Arylboron Compounds: Influence of Solvent Acidity and Boron Substitution”. ChemCatChem. 2013; 5: 3232-3236.

Gross S, Nguyen F, Bierschenk M, Sohmen D, Menzel T, Antes I, Wilson DN, Bach T: “Amythiamicin D and related thiopeptides as inhibitors of the bacterial elongation factor EF-Tu: Modification of the amino acid at carbon atom C2 of ring C dramatically influences the activity”. ChemMedChem. 2013; 8: 1954-1962.

Höke T, Herdtweck E, Bach T: “Hydrogen-bond mediated regio- and enantioselectivity in a C−H amina-tion reaction catalysed by a supramolecular Rh(II) complex”. Chem. Commun. 2013; 49: 8009-8011.

Yin G, Herdtweck E, Bach T: “Enantioselective Access to Bicyclo[4.2.0]octanes by a Sequence of [2+2] Photocycloaddition/Reduction/Fragmentation”. Chem. Eur. J. 2013; 19: 12639-12643.

Coote SC, Bach T: “Enantioselective Intermolecular [2+2] Photocycloadditions of Isoquinolone Mediated by a Chiral Hydrogen-Bonding Template”. J. Am. Chem. Soc. 2013; 135: 14948-14951.

Brimioulle R, Bach T: “Enantioselective Lewis Acid Catalysis of Intramolecular Enone [2+2] Photocy-cloaddition Reactions”. Science. 2013; 342: 840-843.

Potukuchi HK, Bach T: “Selective C-2 Alkylation of Tryptophan by a Pd(II)/Norbornene Promoted C-H Activation Reaction”. J. Org. Chem. 2013; 78: 12263-12267.

Jungbauer SH, Schindler S, Kniep F, Walter S, Rout L, Huber SM: “Multidentate Halogen-Bond Donors as Lewis Acidic Activators or Catalysts in Halide Abstraction Reactions” Synlett. 2013; 24: 2624-2628.

Alexandrova AN, Huber SM, Tavassoli A: “The 3rd Transatlantic Frontiers in Chemistry Symposium” Chem. Eur. J. 2013; 19: 15777-15783.

Kniep F, Jungbauer SH, Zhang Q, Walter SM, Schindler S, Schnapperelle I, Herdtweck E, Huber SM: „Organokatalyse mit neutralen multidentaten Halogenbrückendonoren“. Angew. Chem. 2013; 125: 7166-7170.

Kniep F, Jungbauer SH, Zhang Q, Walter SM, Schindler S, Schnapperelle I, Herdtweck E, Huber SM: “Organocatalysis by Neutral Multidentate Halogen-Bond Donors”. Angew. Chem., Int. Ed. 2013; 52: 7028-7032.

Huber SM, Scanlon JD, Jimenez-Izal E, Ugalde JM, Infante I: “On the directionality of halogen bonding”. Phys. Chem. Chem. Phys. 2013; 15: 10350-10357.

Walter SM, Jungbauer SH, Kniep F, Schindler S, Herdtweck E, Huber SM: “Perfluorinated versus cation-ic multidentate halogen-bond donors: A direct comparison”. J. Fluorine Chem. 2013; 150: 14-20.

Walter SM, Sarwar MG, Chudzinski MG, Herdtweck E, Lough AJ, Huber SM, Taylor MS: “Halogen bond-ing and pi-pi interactions in the solid state structure of a butadiynylene-linked bis(iodoperfluoroarene)”. CrystEngComm. 2013; 15: 3097-3101.

Zhang Q, Tiefenbacher KJ: “Hexameric Resorcinarene Capsule is a Brønsted Acid: Investigation and Application to Synthesis and Catalysis”. J. Am. Chem. Soc. 2013; 135: 16213.

Lehrstuhl für Organische Chemie II Prof. Dr. Stephan A. Sieber

List A, Zeiler E, Gallastegui N, Rusch M, Hedberg C, Sieber SA, Groll M: “Omuralide and Vibralactone: Subtle differences in the proteasome β–lactone-γ-lactam binding scaffold alters target preferences”. Angew. Chem. 2013; 53(2): 571-574.

Gersch M, Kolb R, Alte F, Groll M, Sieber SA: “Disruption of oligomerization and dehydroalanine formati-on as mechanisms for ClpP protease inhibition”. J. Am. Chem. Soc. 2013; 10: 1021/ja4082793

Rudolf GC, Sieber SA: “Copper-Assisted Click Reactions for Activity-Based Proteomics: Fine-Tuned Ligands and Refined Conditions Extend the Scope of Application”. ChemBioChem. 2013; 14: 2447-2455.

Wolf E, Zeißler A, Vosyka O, Zeiler E, Sieber SA, Verhelst SHL: “A New Class of Rhomboid Protease In-hibitors Discovered by Activity-Based Fluorescence Polarization”. PLOS ONE. 2013; 8(8): e72307.

Zeiler E, List A, Alte F, Gersch M, Wachtel R, Poreba M, Drag M, Groll M, Sieber SA: “Structural and functional insights into caseinolytic proteases reveal an unprecedented regulation principle of their cata-lytic triad”. Proc. Natl. Acad. Sci. USA. 2013; 110(28), 11302-11307.

Wirth T, Pestel GF, Ganal V, Kirmeier T, Schuberth I, Rein T, Tietze LF, Sieber SA: “The two faces of po-tent antitumor duocarmycin based drugs: A structural dissection reveals disparate motifs for DNA versus ALDH1A1 affinity”. Angew. Chem., Int. Ed. 2013; 52(27): 6921-6925.

Gersch M, Gut F, Korotkov V, Lehmann J, Böttcher T, Rusch M, Hedberg C, Waldmann H, Klebe G, Sieber SA: “The Mechanism of Caseinolytic Protease (ClpP) Inhibition”, Angew. Chem., Int. Ed. 2013; 52: 3009-3014.

Carl-von-Linde-Professur – TUM Istitute of Advanced Study (IAS) Prof. Dr. Dr. h. c. Horst Kessler

-Moruno C, Dorfner PM, Manzenrieder F, Neubauer S, Reuning U, Burgkart R, Kessler H: “Behavior of primary human osteoblasts on trimmed and sandblasted Ti6Al4V surfaces functionalized with integrin αvβ3-selective cyclic RGD peptides”. J. Biomed. Mater. Res. Part A. 2013; 101A(1): 87-97.

Chatterjee J, Rechenmacher F, Kessler H: “N-Methylation of Peptides and Proteins: An Important Ele-ment for Modulating Biological Functions”. Angew. Chem., Int. Ed. 2013; 52(1): 254-269.

Rechenmacher F, Neubauer S, Polleux J, Mas-Moruno C, De Simone M, Cavalcanti-Adam EA, Spatz JP, Fässler R, Kessler H: “Functionalizing αvβ3- or α5β1-Selective Integrin Antagonists for Surface Coating: A Method to Discriminate Integrin Subtypes In Vitro”. Angew. Chem., Int. Ed. 2013; 52: 1572-1575.

Retzlaff M, Rohrberg J, Küpper NJ, Lagleder S, Bepperling A, Manzenrieder F, Peschek J, Kessler H, Buchner J: “The Regulatory Domain Stabilizes the p53 Tetramer by Intersubunit Contacts with the DNA Binding Domain”. J. Mol. Biol. 2013; 425: 144-155.

Bochen A, Kiran Marelli U, Otto E, Pallarola D, Mas-Moruno C, Saverio Di Leva F, Boehm H, Spatz JP, Novellino E, Kessler H, Marinelli L: “Biselectivity of isoDGR Peptides for Fibronectin Binding Integrin Subtypes α5β1 and αvβ6: Conformational Control through Flanking Amino Acids”. J. Med. Chem. 2013; 56: 1509-1519.

Evellin S, Galvagni F, Zippo A, Neri F, Orlandini M, Incarnato D, Dettori D, Neubauer S, Kessler H, Wag-ner E, Oliviero S: “FOSL1 controls the assembly of endothelial cells into capillary tubes by 2 direct re-pression of αv and β3 integrin transcription”. Mol. Cell. Biol. 2013; 33(6): 1198-1209.

Šimeček J, Hermann P, Havlíčková J, Herdtweck E, Kapp TG, Engelbogen N, Kessler H, Wester HJ, Notni J: “A cyclen-based tetraphosphinate chelator for the preparation of radiolabeled tetrameric bio-conjugates”. Chem. Eur. J. 2013; 19(24): 7748-7757.

Laitinen I, Notni J, Pohle K, Rudelius M, Farrell E, Nekolla SG, Henriksen G, Neubauer S, Kessler H, Wester HJ, Schwaiger M: “Comparison of cyclic RGD peptides for αvβ3 integrin detection in a rat model of myocardial infarction”. EJNMMI Research, 2013; 3: 38.

Rechenmacher F, Neubauer S, Mas-Moruno C, Dorfner PM, Polleux J, Guasch J, Conings B, Boyen HG, Bochen A, Sobahi TR, Burgkart R, Spatz JP, Fässler R, Kessler H: “A Molecular Toolkit for the Function-alization of Ti-Based Biomaterials That Selectively Control Integrin-Mediated Cell Adhesion”. Chem. Eur. J. 2013; 19: 9218-9223.

Rahmouni S, Lindner A, Rechenmacher F, Neubauer S, Sobahi TR, Kessler H, Cavalcanti-Adam EA, Spatz JP: “Hydrogel Micropillars with Integrin Selective Peptidomimetic Functionalized Nanopatterned Tops for the Separate Measurement of Cell Traction Forces Transmitted through αvβ3- or α5β1-Integrins”. Advanced Materials. 2013; 25: 5869-5874.

Müller MA, Opfer J, Volkhardt LA, Brunie L, Sinner EK, Boettiger D, Bochen A, Kessler H, Gottschalk KE, Reuning U: “The glycophorin A transmembrane sequence within integrin αvß3 creates a non-signalling integrin with low basal affinity that is strongly adhesive under force”. J. Mol. Biol. 2013; 425: 2988-3006.

Kiran Marelli U, Rechenmacher F, Ali Sobahi TR, Mas-Moruno C, Kessler H: “Tumor targeting via integrin ligands”. Front. in Pharmacol. of Anti-Cancer Drugs. 2013; 3.

Kapp TG, Rechenmacher F, Sobahi TR, Kessler H: “Integrin modulators: a patent review”. Expert Opin. Ther. Pat. 2013; 23(10): 1273-1295.

Neubauer S, Rechenmacher F, Beer AJ, Curnis F, Pohle K, D´Alessandria C, Wester HJ, Reuning U, Corti A, Schwaiger M, Kessler H: “Selective imaging of the angiogenic relevant integrins α5β1 and αvβ3”. An-gew. Chem., Int. Ed. 2013; 52: 11656-11659.

Fachgebiet Festkörper-NMR-Spektroskopie Prof. Dr. Bernd Reif

Jacso T, Bardiaux B, Broecker J, Fiedler S, Baerwinkel T, Mainz A, Fink U, Vargas C, Oschkinat H, Keller S, Reif B: “The Mechanism of Denaturation and the Unfolded State of the α-Helical Membrane-Associated Protein Mistic”. J. Am. Chem. Soc. 2013; 135: 18884-18891.

Zinkevich T, Chevelkov V, Reif B, Saalwächter K, Krushelnitzky A: “Multi-frequency 15N solid-state NMR relaxation analysis of protein dynamics validates motional models and offers surprising sensitivity to slow motions with very high order parameters”. J. Biomol. NMR. 2013; 57: 219-235.

Asami S, Reif B: “Proton-detected solid-state NMR at aliphatic sites: Applications to Crystalline Sys-tems”. Acc. Chem. Res. 2013; 46: 2089-2097.

Lopez del Amo JM, Schneider D, Lange A, Reif B: “Field Cryogenic solid-state NMR studies of fibrils of the Alzheimer's disease amyloid-β peptide: Perspectives for DNP”. J. Biomol. NMR. 2013; 56: 359-363.

Mainz A, Religa T, Sprangers R, Linser R, Kay LE, Reif B: “Proton detection of MDa sized protein com-plexes in solution by MAS solid-state NMR”. Angew. Chem., Int. Ed. 2013; 52: 8746-8751.

Agarwal V, Linser R, Dasari M, Fink U, Lopez del Amo JM, Reif B: “Hydrogen bonding involving side chain exchangeable groups stabilizes amyloid quarternary structure”. Phys. Chem. Chem. Phys. 2013; 15: 12551-12557.

Ravera E, Parigi G, Mainz A, Religa TL, Reif B, Luchinat C: “Experimental Determination of Microsecond Reorientation Correlation Times in Protein Solutions”. J. Phys. Chem. B. 2013; 117: 3548-3553.

Asami S, Rakwalska-Bange M, Carlomagno T, Reif B: “Protein/RNA interfaces probed by 1H detected MAS solid-state NMR”. Angew. Chem., Int. Ed. 2013; 52: 2345-2349.

Fachgebiet Organische Chemie Prof. Dr. Lukas Hintermann

Schlüter J, Blazejak M, Hintermann L: “Aluminum-Catalyzed Hydroalkoxylation at Elevated Tempera-tures: Fast and Simple Access to Coumarans and Other Oxygen Heterocycles”. ChemCatChem. 2013; 5: 3309-3315.

Maltsev OV, Walter V, Brandl MJ, Hintermann, L: “Medium Buffer Effects on the Condensation of L-Cysteine and Aryl Nitriles to (R)-2-Aryl-4,5-dihydrothiazole-4-carboxylic Acids”. Synthesis. 2013; 45: 2763-2767.

Stochkel K, Hansen CN, Houmoller J, Nielsen LM, Anggara K, Linares M, Norman P, Nogueira F, Maltsev OV, Hintermann L, Nielsen SB, Naumov P, Milne BF: “On the Influence of Water on the Electron-ic Structure of Firefly Oxyluciferin Anions from Absorption Spectroscopy of Bare and Monohydrated Ions in Vacuo”. J. Am. Chem. Soc. 2013; 135: 6485-6493.

Wu H, Hintermann L: “Transfer Hydrogenations of Alkenes with Formate on Pd/C: Synthesis of Dihydro-cinchona Alkaloids”. Synthesis. 2013; 45: 888-892.

Hintermann L, Ackerstaff J, Boeck F: “Inner Workings of a Cinchona Alkaloid Catalyzed Oxa-Michael Cyclization: Evidence for a Concerted Hydrogen-Bond-Network Mechanism”. Chem. Eur. J. 2013; 19: 2311-2321.

Hintermann L, Schmitz M, Maltsev OV, Naumov P: “Organocatalytic Stereoisomerization versus Alkene Isomerization: Catalytic Asymmetric Synthesis of 1-Hydroxy-trans-2,5-diphenylphospholane 1-Oxide”. Synthesis. 2013; 45: 308-325.

Rebarz M, Kukovec BM, Maltsev OV, Ruckebusch C, Hintermann L, Naumov P, Sliwa M: “Deciphering the protonation and tautomeric equilibria of firefly oxyluciferin by molecular engineering and multivariate curve resolution”. Chemical Science. 2013; 4: 3803-3809.

Fachgebiet Organische Chemie Prof. Dr. Steffen Glaser

Nimbalkar M, Luy B, Skinner TE, Neves JL, Gershenzon NI, Kobzar K, Bermel W, Glaser SJ: “The Fan-tastic Four: A Plug 'n' Play Set of Optimal Control Pulses for Enhancing NMR Spectroscopy”. J. Magn. Reson. 2013; 228: 16-31.

Zhang G, Schilling F, Glaser SJ, Hilty C: “Chemical Shift Correlations from Hyperpolarized NMR using a single SHOT”. Anal. Chem. 2013; 85: 2875-2881.

Spindler PE, Glaser SJ, Skinner TE, Prisner TF: “Broadband Inversion PELDOR with Partially Adiabatic Shaped Pulses”. Angew. Chem., Int. Ed. 2013; 52: 3425-3429.

Schulte RF, Sperl JI, Weidl E, Menzel MI, Janich MA, Khegai O, Durst M, Ardenkjaer-Larsen JH, Glaser SJ, Haase A, Schwaiger M, Wiesinger F: “Saturation-Recovery Metabolic Exchange Rate Imaging with Hyperpolarised 1-13C Pyruvate using Spectral-Spatial Excitation”. Magn. Reson. Med. 2013; 69: 1209-1216.

Schilling F, Düwel S, Köllisch U, Durst M, Schulte RF, Glaser SJ, Haase A, Otto A, Menzel MI: “Diffusion of Hyperpolarized 13C-Metabolites in Tumor Cell Spheroids Using Real-Time NMR Spectroscopy”. NMR Biomed. 2013; 26: 557-568.

Edwards D, Zhang Y, Glaser SJ, Han S, Sherwin M: “Phase Cycling with a 240 GHz Free Electron Laser-Powered Electron Paramagnetic Resonance Spectrometer”. Phys. Chem. Chem. Phys. 2013; 15: 5707-5729.

Lapert M, Assemat E, Zhang Y, Glaser SJ, Sugny D: “Time-Optimal Control of Spin 1/2 Particles with Dissipative and Radiation Damping Effects”. Phys. Rev. A. 2013; 87: 043417.

Kaufmann T, Franck JM, Keller TJ, Barnes RP, Glaser SJ, Martinis JM, Han S: “DAC-Board Based X-Band EPR Spectrometer with Arbitrary Waveform Control”. J. Magn. Reson. 2013; 235: 95-108.

Lapert M, Assmat E, Glaser SJ, Sugny D: “Understanding the Global Structure of Two-Level Quantum Systems with Relaxation: Vector Fields, Magic Plane and Steady-State Ellipsoid”. Phys. Rev. A. 2013; 88: 033407.

Assemat E, Lapert M, Sugny D, Glaser SJ: “On the Application of Geometric Optimal Control Theory to Nuclear Magnetic Resonance”. Mathematical Control and Related Fields. 2013; 3: 375-396.

Garon A, Glaser SJ, Sugny D: “Time-Optimal Control of SU(2) Quantum Operations”. Phys. Rev. A. 2013; 88: 043422.

Huckle TK, Waldherr, K, Schulte-Herbrüggen T: “Computations in Quantum Tensor Networks”. Linear Algebra Appl. 2013; 438: 750-781.

Huckle TK, Waldherr, K, Schulte-Herbrüggen T: “Exploitig Matric Symmetries and Physical Symmetries in Matrix Product States and Tensor Trains”. Lin. Multilin. Alg. 2013; 61: 91-122.

Fachgebiet Proteinchemie Prof. Dr. Aymelt Itzen

Guo Z, Hou X, Goody RS, Itzen A: “Intermediates in the Guanine Nucleotide Exchange Reaction of Rab8 Catalyzed by Rabin8/GRAB”. J. Biol. Chem. 2013; 288: 32466-32474.

Rothmeier E, Pfaffinger G, Hoffmann C, Harrison CF, Grabmayr H, Repnik U, Hannemann M, Wolke S, Bausch A, Griffiths G, Muller-Taubenberger A, Itzen A, Hilbi H: “Activation of Ran GTPase by a Legionel-la Effector Promotes Microtubule Polymerization, Pathogen Vacuole Motility and Infection”. PLOS Pathog. 2013; 9: e1003598.

Blümer J, Rey J, Dehmelt L, Mazel T, Wu YW, Bastiaens P, Goody RS, Itzen A: “RabGEFs are a major determinant for specific Rab membrane targeting”. J. Cell Biol. 2013; 200: 287-300.

Gazdag EM, Streller A, Haneburger I, Hilbi H, Vetter IR, Goody RS, Itzen A: “Mechanism of Rab1b deac-tivation by the Legionella pneumophila GAP LepB”. EMBO Rep. 2013; 14: 199-205.

Gavriljuk K, Itzen A, Goody RS, Gerwert K, Kotting C: “Membrane extraction of Rab proteins by GDP dissociation inhibitor characterized using attenuated total reflection infrared spectroscopy”. Proc. Natl. Acad. Sci. USA. 2013; 110: 13380-13385.

Goody RS, Itzen A: “Modulation of Small GTPases by Legionella”. Curr. Top. Microbiol. Immunol. 2013; 376: 117-133.

Physikalische und Theoretische Chemie

Lehrstuhl für Technische Elektrochemie Prof. Dr. Hubert A. Gasteiger

Kavakli C, Meini S, Harzer G, Tsiouvaras N, Piana M, Siebel A, Garsuch A, Gasteiger HA, Herranz J: “Nanosized Carbon-Supported Manganese Oxide Phases as Lithium-Oxygen Cathode Catalysts”. ChemCatChem. 2013; 5: 3358-3373.

Zhang J, Gasteiger HA, Gu W: “Electrochemical Measurement of the Oxygen Permeation Rate through Polymer Electrolyte Membranes”. J. Electrochem. Soc. 2013; 160: F616-A622.

Suntivich J, Xu Z, Carlton CE, Kim J, Han B, Lee SW, Bonnet N, Marzari N, Allard LF, Gasteiger HA, Hamad-Schifferli K, Shao-Horn Y: “Surface Composition Tuning of Au-Pt Bimetallic Nanoparticles for Enhanced Carbon Monoxide and Methanol Electro-oxidation”. J. Am. Chem. Soc. 2013; 135: 7985-7991.

Tsiouvaras N, Meini S, Buchberger I, Gasteiger HA: “A Novel On-Line Mass Spectrometer Design for the Study of Multiple Charging Cycles of a Li-O2 Battery”. J. Electrochem. Soc. 2013; 160: A471-A477.

Bernhard R, Latini A, Panero S, Scrosati B, Hassoun J: “Poly(ethylenglycol)dimethylether-lithium bis(trifluoromethanesulfonyl)imide, PEG500DME-LiTFSI, as high viscosity electrolyte for lithium ion bat-teries”. J. Power Sources. 2013; 226: 329-333.

Meini S, Tsiouvaras N, Schwenke KU, Piana M, Beyer H, Lange L, Gasteiger HA: “Rechargeability of Li-air cathodes pre-filled with discharge products using an ether based electrolyte solution: implications for cycle-life of Li-air cells”. Phys. Chem. Chem. Phys. 2013; 15: 11478-11493.

Meini S, Tsiouvaras N, Piana M, Gasteiger HA: “Thermal and Electrochemical Decomposition of Lithium Peroxide in Non-Catalyzed Carbon Cathodes for Li-Air Batteries”. Phys. Chem. Chem. Phys. 2013; 15: 11025-11037.

Schwenke KU, Meini S, Wu X, Gasteiger HA, Piana M: “Stability of superoxide radicals in glyme solvents for non-aqueous Li-O2 battery electrolytes”. Phys. Chem. Chem. Phys. 2013; 15: 11830-11839.

Lehrstuhl für Theoretische Chemie Prof. Dr. Wolfgang Domcke, Prof. Dr. Karsten Reuter, PD Dr. Sergy Yu. Grebenshchikov

Gelin MF, Rao BJ, Nest M, Domcke W: “Domain of validity of the perturbative approach to femtosecond optical spectroscopy”. J. Chem. Phys. 2013; 139: 224107.

Gelin MF, Tanimura Y, Domcke W: “Simulation of femtosecond “double-slit” experiments for a chromo-phore in a dissipative environment”. J. Chem. Phys. 2013; 139: 214302.

Gelin MF, Domcke W: “Simple Recipes for Separating Excited-State Absorption and Cascading Signals by Polarization-Sensitive Measurements”. J. Phys. Chem. A. 2013; 117: 11509-11513.

Jelic J, Denysenko D, Volkmer D, Reuter K: “Computational screening study towards redox-active met-al-organic frameworks”. New J. Phys. 2013; 15: 115004.

Schott V, Oberhofer H, Birkner A, Xu M, Wang Y, Muhler M, Reuter K, Wöll C: “Chemical Activity of Thin Oxide Layers: Strong Interactions with the Support Yield a New Thin-Film Phase of ZnO”. Angew. Chem., Int. Ed. 2013; 52: 11925-11929.

Bukas VJ, Meyer J, Alducin M, Reuter K: “Ready, Set and no Action: A Static Perspective on Potential Energy Surfaces commonly used in Gas-Surface Dynamics”. Z. Phys. Chem. 2013; 227: 1523-1542.

Delchev VB, Domcke W: “Ab initio study of the cyclodimerization of uracil through butane-like and ox-etane-like conical intersections”. J. Photochem. Photobiol. A. 2013; 271: 1-7.

Wang T, Jelic J, Rosenthal D, Reuter K: “Exploring Pretreatment-Morphology Relationships: Ab Initio Wulff Construction for RuO2 Nanoparticles under Oxidising Conditions”. ChemCatChem. 2013; 5: 3398-3403.

Gopakumar TG, Davran-Candan T, Bahrenburg J, Maurer RJ, Temps F, Reuter K, Berndt R: “Broken Symmetry of an Adsorbed Molecular Switch Determined by Scanning Tunneling Spectroscopy”. Angew. Chem., Int. Ed. 2013; 52: 11007-11010.

Huynh TD, Sun KW, Gelin M, Zhao Y: “Polaron dynamics in two-dimensional photon-echo spectroscopy of molecular rings”. J. Chem. Phys. 2013; 139: 104103.

Sellner B, Barbatti M, Müller T, Domcke W, Lischka H: “Ultrafast non-adiabatic dynamics of ethylene in-cluding Rydberg states”. Mol. Phys. 2013; 111: 2439-2450.

Krcmar J, Gelin MF, Domcke W: “Calculation of third-order signals via driven Schrödinger equations: General results and application to electronic 2D photon echo spectroscopy”. Chem. Phys. 2013; 422: 53-62.

Szabla R, Tuna D, Gora RW, Sponer J, Sobolewski AL, Domcke W: “Photochemistry of 2-Aminooxazole, a Hypothetical Prebiotic Precursor of RNA Nucleotides”. J. Phys. Chem. Lett. 2013; 4: 2785-2788.

Palagin D, Teufl T, Reuter K: “Multidoping of Si Cages: High Spin States beyond the Single-Dopant Sep-tet Limit”. J. Phys. Chem. C. 2013; 117: 16182-16186.

Oberhofer H, Reuter K: “First-principles thermodynamic screening approach to photo-catalytic water splitting with co-catalysts”. J. Chem. Phys. 2013; 139: 044710.

Mercurio G, Maurer RJ, Liu W, Hagen S, Leyssner F, Tegeder P, Meyer J, Tkatchenko A, Soubatch S, Reuter K, Tautz FS: “Quantification of finite-temperature effects on adsorption geometries of p-conjugated molecules: Azobenzene/Ag(111)”. Phys. Rev. B. 2013; 88: 035421.

Maurer RJ, Reuter K: “Excited-state potential-energy surfaces of metal-adsorbed organic molecules from linear expansion Delta-self-consistent field density-functional theory (Delta SCF-DFT)”. J. Chem. Phys. 2013; 139: 014708.

Gelin MF, Belyaev AK, Domcke W: “Pump-probe spectroscopy with strong pulses as a tool to enhance weak electronic transitions”. Phys. Rev. A. 2013; 87: 063416.

Grebenshchikov SY: “Photodissociation of carbon dioxide in singlet valence electronic states. I. Six mul-tiply intersecting ab initio potential energy surfaces”. J. Chem. Phys. 2013; 138: 224106.

Grebenshchikov SY: “Photodissociation of carbon dioxide in singlet valence electronic states. II. Five state absorption spectrum and vibronic assignment”. J. Chem. Phys. 2013; 138: 224107.

Ulrich CK, Chen J, Tokel O, Houston PL, Grebenshchikov SY: “Photodissociation of Ozone from 321 to 329 nm: The Relative Yields of O(P-3(2)) with O-2(X (3)Sigma(-)(g)), O-2(a (1)Delta(g)) and O-2(b (l)Sigma(+)(g))”. J. Phys. Chem. A. 2013; 117: 12011-12019.

Opalka D, Domcke W: "Interpolation of multi-sheeted multi-dimensional potential-energy surfaces via a linear optimization procedure". J. Chem. Phys. 2013; 138: 224103.

Domcke W, Sobolewski AL: "Peptide deactivation: Spectroscopy meets theory". Nature Chem. 2013; 5: 257-258.

Gajdos F, Oberhofer H, Dupuis M, Blumberger J: "On the Inapplicability of Electron-Hopping Models for the Organic Semiconductor Phenyl-C61-butyric Acid Methyl Ester (PCBM)". J. Phys. Chem. Lett. 2013; 4: 1012-1017.

Gahl C, Brete D, Leyssner F, Koch M, McNellis ER, Mielke J, Carley R, Grill L, Reuter K, Tegeder P, Weinelt M: "Coverage- and Temperature-Controlled Isomerization of an Imine Derivative on Au(111)". J. Am. Chem. Soc. 2013; 135: 4273-4281.

Blomberg S, Hoffmann MJ, Gustafson J, Martin NM, Fernandes VR, Borg A, Liu Z, Chang R, Matera S, Reuter K, Lundgren E: "In Situ X-Ray Photoelectron Spectroscopy of Model Catalysts: At the Edge of the Gap". Phys. Rev. Lett. 2013; 110: 117601.

Strobusch D, Scheurer C: "A general nuclear motion Hamiltonian and non-internal curvilinear coordi-nates". J. Chem. Phys. 2013; 138: 094107.

Gelin MF, Bondarev IV, Meliksetyan AV: "Monitoring bipartite entanglement in hybrid carbon nanotube systems via optical 2D photon-echo spectroscopy". Chem. Phys. 2013; 413: 123-131.

Palagin D, Reuter K: "M Si20 H20 Aggregates: From Simple Building Blocks to Highly Magnetic Func-tionalized Materials". ACS Nano. 2013; 7: 1763-1768.

Sirtl T, Schlögl S, Rastgoo-Lahrood A, Jelic J, Neogi S, Schmittel M, Heckl WM, Reuter K, Lackinger M: "Control of Intermolecular Bonds by Deposition Rates at Room Temperature: Hydrogen Bonds versus Metal Coordination in Trinitrile Monolayers". J. Am. Chem. Soc. 2013; 135: 691-695.

Samsonyuk A, Scheurer C: "Configuration space partitioning and matrix buildup scaling for the vibra-tional configuration interaction method". J. Comp. Chem. 2013; 34: 27-37.

Ramesh SG, Domcke W: "A multi-sheeted three-dimensional potential-energy surface for the H-atom photodissociation of phenol". Faraday Discuss. 2013; 163: 73-94.

Sirtl T, Jelic J, Meyer J, Das K, Heckl WM, Moritz W, Rundgren J, Schmittel M, Reuter K, Lackinger M: "Adsorption structure determination of a large polyaromatic trithiolate on Cu(111): combination of LEED-I(V) and DFT-vdW". Phys. Chem. Chem. Phys. 2013; 15: 11054-11060.

Gelin MF, Egorova D, Domcke W: "Strong-pump strong-probe spectroscopy: effects of higher excited electronic states". Phys. Chem. Chem. Phys. 2013; 15: 8119-8131.

Liu X, Sobolewski AL, Borrelli R, Domcke W: "Computational investigation of the photoinduced homolyt-ic dissociation of water in the pyridine-water complex". Phys. Chem. Chem. Phys. 2013; 15: 5957-5966.

Lehrstuhl für Physikalische Chemie Prof. Ueli Heiz, Prof. Ulrich Boesl-von Grafenstein, PD Dr. Friedrich Esch

  • Fukamori, Yves; König, Michael; Yoon, Bokwon; Wang, Bo; Esch, Friedrich; Heiz, Ueli; Landman, Uzi: Fundamental Insight into the Substrate-Dependent Ripening of Monodisperse Clusters. ChemCatChem (11), 2013, 3330-3341 more…
  • Peronio, Angelo; Cepellotti, Andrea; Marchini, Stefano; Abdurakhmanova, Nasiba; Dri, Carlo; Africh, Cristina; Esch, Friedrich; Peressi, Maria; Comelli, Giovanni: NH 3 –NO Coadsorption System on Pt(111). I. Structure of the Mixed Layer. The Journal of Physical Chemistry C 117 (41), 2013, 21186-21195 more…
  • Cepellotti, Andrea; Peronio, Angelo; Marchini, Stefano; Abdurakhmanova, Nasiba; Dri, Carlo; Africh, Cristina; Esch, Friedrich; Comelli, Giovanni; Peressi, Maria: NH 3 –NO Coadsorption System on Pt(111). II. Intermolecular Interaction. The Journal of Physical Chemistry C 117 (41), 2013, 21196-21202 more…
  • Boesl, Ulrich; Bornschlegl, Alexander; Logé, Christoph; Titze, Katharina: Resonance-enhanced multiphoton ionization with circularly polarized light: chiral carbonyls. Analytical and Bioanalytical Chemistry 405 (22), 2013, 6913-6924 more…
  • Parry, Imogen S.; Kartouzian, Aras; Hamilton, Suzanne M.; Balaj, O. Petru; Beyer, Martin K.; Mackenzie, Stuart R.: Collisional Activation of N 2 O Decomposition and CO Oxidation Reactions on Isolated Rhodium Clusters. The Journal of Physical Chemistry A 117 (36), 2013, 8855-8863 more…
  • Kartouzian, Aras; Heister, Philipp; Thämer, Martin; Gerlach, Sabine; Heiz, Ulrich: In-line reference measurement for surface second harmonic generation spectroscopy. Journal of the Optical Society of America B 30, 2013, 541 more…
  • Kartouzian, Aras: Cluster-assembled metallic glasses. Nanoscale Research Letters, 2013, 339 more…
  • Kunz, Sebastian; Schreiber, Patrick; Ludwig, Martin; Maturi, Mark M.; Ackermann, Olaf; Tschurl, Martin; Heiz, Ueli: Rational design, characterization and catalytic application of metal clusters functionalized with hydrophilic, chiral ligands: a proof of principle study. Physical Chemistry Chemical Physics 15 (44), 2013, 19253 more…
  • Zhang, Xinxing; Visser, Bradley; Tschurl, Martin; Collins, Evan; Wang, Yi; Wang, Qian; Li, Yawei; Sun, Qiang; Jena, Puru; Gantefoer, Gerd; Boesl, Ulrich; Heiz, Ulrich; Bowen, Kit: Communication: In search of four-atom chiral metal clusters. The Journal of Chemical Physics 139 (11), 2013, 111101 more…
  • Nesselberger, Markus; Kunz, Sebastian; Schweinberger, Florian Frank; Schlögl, Katrin; Mayrhofer, Karl JJ; Heiz, Ueli; Arenz, Matthias: Size-Selected Platinum Clusters as Electrocatalysts for the Oxygen Reduction Reaction. ECS Trans. 50 (2), 2013, 1333-1338 more…
  • Schweinberger, F. F.; Crampton, A. S.; Zimmermann, T.; Kwon, G.; Ridge, C. J.; Günther, S.; Heiz, U.: Submonolayer sensitive adsorption study of trichloroethene on single crystal surfaces by means of MIES, UPS and TPD. Surf. Sci. 609 (0), 2013, 18-29 more…
  • Nesselberger, Markus; Roefzaad, Melanie; Fayçal Hamou, R.; Ulrich Biedermann, P.; Schweinberger, Florian F.; Kunz, Sebastian; Schloegl, Katrin; Wiberg, Gustav K. H.; Ashton, Sean; Heiz, Ueli; Mayrhofer, Karl J. J.; Arenz, Matthias: The effect of particle proximity on the oxygen reduction rate of size-selected platinum clusters. Nat Mater 12, 2013, 919 more…
  • Farrag, Mostafa; Tschurl, Martin; Dass, Amala; Heiz, Ulrich: Infra-red spectroscopy of size selected Au25, Au38 and Au144 ligand protected gold clusters. Phys. Chem. Chem. Phys. 15 (30), 2013, 12539-12542 more…
  • Farrag, Mostafa; Tschurl, Martin; Heiz, Ulrich: Chiral gold and silver nanoclusters: preparation, size selection, and chiroptical properties. Chem. Mater. 25 (6), 2013, 862-870 more…
  • Schweinberger, Florian F; Berr, Maximilian J; Döblinger, Markus; Wolff, Christian; Sanwald, Kai E; Crampton, Andrew S; Ridge, Claron J; Jäckel, Frank; Feldmann, Jochen; Tschurl, Martin; Heiz, Ulrich: Cluster size effects in the photocatalytic hydrogen evolution reaction. J Am Chem Soc 135 (36), 2013, 13262 more…

Fachgebiet Physikalische Chemie mit Schwerpunkt Katalyse Prof. Dr. Sebastian Günther

  • Günther, Sebastian; Böcklein, Sebastian; Wintterlin, Joost; Niño, Miguel A.; Menteş, Tevfik O.; Locatelli, Andrea: Locating Catalytically Active Oxygen on Ag(1 1 1)-A Spectromicroscopy Study. ChemCatChem (11), 2013, 3342-3350 more…
  • Kraus, Jürgen; Böcklein, Sebastian; Reichelt, Robert; Günther, Sebastian; Santos, Benito; Menteş, Tevfik O.; Locatelli, Andrea: Towards the perfect graphene membrane? – Improvement and limits during formation of high quality graphene grown on Cu-foils. Carbon 64, 2013, 377-390 more…
  • Alfè, D.; Pozzo, M.; Miniussi, E.; Günther, S.; Lacovig, P.; Lizzit, S.; Larciprete, R.; Burgos, B. Santos; Menteş, T. O.; Locatelli, A.; Baraldi, A.: Fine tuning of graphene-metal adhesion by surface alloying. Scientific Reports, 2013 more…
  • Böcklein, Sebastian; Günther, Sebastian; Wintterlin, Joost: High-Pressure Scanning Tunneling Microscopy of a Silver Surface during Catalytic Formation of Ethylene Oxide. Angew. Chem. Int. Ed. 52 (21), 2013, 5518-5521 more…
  • Böcklein, S.; Günther, S.; Reichelt, R.; Wyrwich, R.; Joas, M.; Hettstedt, C.; Ehrensperger, M.; Sicklinger, J.; Wintterlin, J.: Detection and quantification of steady-state ethylene oxide formation over an Ag(111) single crystal. Journal of Catalysis 299, 2013, 129-136 more…
  • Schweinberger, F.F.; Crampton, A.S.; Zimmermann, T.; Kwon, G.; Ridge, C.J.; Günther, S.; Heiz, U.: Submonolayer sensitive adsorption study of trichloroethene on single crystal surfaces by means of MIES, UPS and TPD. Surface Science 609, 2013, 18-29 more…
  • Günther, Sebastian; Dänhardt, Sebastian; Ehrensperger, Martin; Zeller, Patrick; Schmitt, Stefan; Wintterlin, Joost: High-Temperature Scanning Tunneling Microscopy Study of the Ordering Transition of an Amorphous Carbon Layer into Graphene on Ruthenium(0001). ACS Nano, 2013, 154-164 more…
  • Günther, S.; Liu, Hong; Menteş, T. O.; Locatelli, A.; Imbihl, R.: Spectromicroscopy of pulses transporting alkali metal in a surface reaction. Phys. Chem. Chem. Phys. 15 (22), 2013, 8752 more…

Technische Chemie

Lehrstuhl für Technische Chemie I Prof. Dr.-Ing. Kai-Olaf Hinrichsen

Simson G, Prasetyo E, Reiner S, Hinrichsen O: “Continuously operated precipitation of Cu/ZnO/Al2O3 catalysts for methanol synthesis in microstructured reactors with alternative precipitating agents”. Appl. Catal. A: General. 2013; 450: 1-12.

Haseidl F, Jacobsen NC, Hinrichsen O: “Process Intensification on Synthesis of Nanoparticles in a Spin-ning Disc Reactor”. Chemie Ingenieur Technik. 2013; 85: 540-549.

Liu Y, Hinrichsen O: “Numerical Simulation of Tube Erosion in a Bubbling Fluidized Bed with a Dense Tube Bundle”. Chem. Eng. Technol. 2013; 36: 635-644.

Habla F, Dietsche L, Hinrichsen O: “Modeling and Simulation of Conditionally Volume Averaged Viscoe-lastic Two-Phase Flows”. AIChE Journal. 2013; 59: 3914-3927.

Habla F, Hinrichsen O: “Semi-implicit stress formulation for viscoelastic models: Application to three-dimensional contraction flows”. Journal of Non-Newtonian Fluid Mechanics. 2013; 199: 70-79.

Habla F, Obermeier S, Dietsche L, Kintzel O, Hinrichsen O: “CFD Analysis of the Frame Invariance of the Melt Temperature Rise in a Single-Screw Extruder”. International Polymer Processing. 2013; 28: 463–469.

Marschall H, Hinrichsen O: “Numerical Simulation of Multi-Scale Two-Phase Flows Using a Hybrid Inter-face-Resolving Two-Fluid Model (HIRES-TFM)”. Journal of Chemical Engineering of Japan. 2013; 46: 517-523.

Baerns M, Behr A, Brehm A, Gmehling J, Hinrichsen O, Hofmann H, Onken U, Palkovits R, Renken A, Technische Chemie, 2. Auflage, Wiley-VCH, 2013.

Lehrstuhl für Technische Chemie II Prof. Dr. Johannes A. Lercher, Prof. Dr. Andreas Jentys

Shi H, Gutiérrez OY, Haller GL, Mei D, Rousseau R, Lercher JA: “Structure sensitivity of hydrogenolytic cleavage of endocyclic and exocyclic C–C bonds in methylcyclohexane over supported iridium parti-cles”. J. Catal. 2013; 297: 70-78.

Zhao C, Yu Y, Jentys A, Lercher JA: “Understanding the impact of aluminum oxide binder on Ni/HZSM-5 catalysts”. Appl. Catal. B: Environmental. 2013; 132: 282-292.

Kouva SK, Kanervo JM, Schüβler F, Olindo R, Lercher JA, Krause AOI: “Sorption and diffusion parame-ters from vacuum-TPD of ammonia on H-ZSM-5”. Chem. Eng. Sci. 2013; 89: 40-48.

Kim J, Jentys A, Maier SM, Lercher JA: “Characterization of Fe-exchanged BEA zeolite under NH3-SCR conditions”. J. Phys. Chem. C. 2013; 117: 986-993.

Shi H, Gutiérrez OY, Haller GL, Lercher JA: “Promoting ring opening reactions of cyclopentane on Pt/Al2O3 by chloride anions decorating supported metal particles”. ACS Catalysis. 2013; 3: 328-338.

Zhao C, Lercher JA: “Catalytic depolymerization and upgrading of lignin”. The Role of Catalysis for the Sustainable Production of Bio-fuels and Bio-chemicals pp 291, Triantafyllidis et al. Eds., Elsevier. 2013; 9: 289-320.

Gärtner GA, van Veen AC, Lercher JA: “Oxidative dehydrogenation of ethane – Common principles and mechanistic aspects”. ChemCatChem. 2013: 5: 3196-3218.

Peng B, Yuan X, Zhao C, Lercher JA: “Manipulating catalytic pathways - Catalytic deoxygenation of palmitic acid on multi-functional catalysts”. Chem. Eur. J. 2013; 19: 4732-4741.

Ahn JH, Kolvenbach R, Al-Khattaf SS, Jentys A, Lercher JA: “Methanol usage in toluene methylation with medium and large pore zeolites”. ACS Catalysis. 2013; 3: 817-825.

Reiner S, Jentys A, Lercher JA: “Dynamic self-organization of supported Pd/Au catalysts during vinyl acetate synthesis”. J. Phys. Chem. C. 2013; 117: 8161-8169.

Schäfer S, Wyrzgol SA, Lercher JA, Stutzmann M, Sharp ID: “Charge transfer across the GaN/Pt nano-particle interface in electrolyte”. ChemCatChem. 2013; 5: 3224-3227.

Yu Y, Jentys A, Haller GL, Colby R, Kabius B, Gutiérrez OY, Lercher JA: “Tailoring silica alumina sup-ported Pt-Pd as poison tolerant catalysts for aromatics hydrogenation”. J. Catal. 2013; 304: 135-148.

Song W, Zhao C, Lercher JA: “Critical importance of size distribution of supported Ni particles for cata-lyst stability in hydrodeoxygenation”. Chem. Eur. J. 2013; 19: 9833-9842.

Zhao C, Brück T, Lercher JA: “Catalytic deoxygenation of microalgae oil to green hydrocarbons”. Green Chem. 2013; 15(7): 1697-2012.

Gutiérrez OY, Yu Y, Kolvenbach R, Haller GL, Lercher JA: “Hydrogenation of tetralin over Pt catalysts supported on sulfated zirconia and amorphous silica alumina”. Catal. Sci. Technol. 2013; 3: 2365-2372.

Basaran D, Genest A, Lercher JA, Rösch N: “Formation of CO2 and ethane from propionyl over platinum - A DFT study”. ACS Catalysis. 2013; 3: 1730-1738.

Lemonidou A, Vagia EC, Lercher JA: “Acetic acid reforming over Rh supported on La2O3/CeO2/ZrO2 - Catalytic performance and reaction pathway analysis”. ACS Catalysis. 2013; 3: 1919-1928.

Chase Z, Fulton JL, Pham V, Camaioni DM, Balasubramanian M, Mei D, Weber R, Zhao C, Lercher JA: “State of supported Pd during catalysis in water”. J. Phys. Chem. C. 2013; 117: 17603-17612.

Gutiérrez OY, Zhong L, Zhu Y, Lercher JA: “Synthesis of methanethiol from CS2 on Ni-, Co-, and K-doped MoS2/SiO2 catalysts”. ChemCatChem. 2013; 5: 3249-3260.

Ahn JH, Kolvenbach R, Al-Khattaf SS, Jentys A, Lercher JA: “Enhancing shape selectivity without loss of activity – novel mesostructured ZSM5 catalysts for methylation of toluene to pxylene”. Chem. Commun. 2013; 49: 10584-10586.

Kolvenbach R, Gonzalez-Peňa LF, Jentys A, Lercher JA: “Molecular understanding of sorption in mesoscale organized zeolites with MFI structure”. Catal. Lett. 2013; 143: 1116-1122.

WACKER-Lehrstuhl für Makromolekulare Chemie Prof. Dr. Dr. h. c. Bernhard Rieger

Anderson CE, Vagin SI, Hammann M, Zimmermann L, Rieger B: “Copolymerisation of Propylene Oxide and Carbon Dioxide by Dinuclear Cobalt Porphyrins”. ChemCatChem. 2013; 5: 3269-3280.

Anger C, Deubel F, Salzinger S, Stohrer J, Halbach T, Jordan R, Veinot JGC, Rieger B: “Organic-Inorganic Hybrid Nanoparticles via Photoinduced Micellation and Siloxane Core Cross-Linking of Stimu-li-Responsive Copolymers”. ACS Macro Letters. 2013; 2: 121-124.

Deubel F, Bretzler V, Holzner R, Helbich T, Nuyken O, Rieger B, Jordan R: “Polythioethers by Thiol-Ene Click Polyaddition of α,ω-Alkylene Thiols”. Macromol. Rapid Commun. 2013; 34: 1020-1025.

Erhardt SA, Hoffmann F, Daiss JO, Stohrer J, Herdtweck E, Rieger B: “Synthesis of 2,2,5,5-Tetrasubstituted 1,4-Dioxa-2,5-disilacyclohexanes via Organotin(IV)-Catalyzed Transesterification of (Acetoxymethyl)alkoxysilanes”. Chem. Eur. J. 2013; 19: 4818-4825.

Feigl A, Chiorescu I, Deller K, Heidsieck SUH, Buchner MR, Karttunen V, Bockholt A, Genest A, Roesch N, Rieger B: “Metal-Free Polymerization of Phenylsilane: Tris(pentafluorophenyl)borane-Catalyzed Syn-thesis of Branched Polysilanes at Elevated Temperatures”. Chem. Eur. J. 2013; 19: 12526-12536.

Hindelang K, Kronast A, Vagin SI, Rieger B: “Functionalization of Metal-Organic Frameworks through the Postsynthetic Transformation of Olefin Side Groups”. Chem. Eur. J. 2013; 19: 8244-8252.

Lehenmeier MW, Kissling S, Altenbuchner PT, Bruckmeier C, Deglmann P, Brym AK, Rieger B: “Flexibly Tethered Dinuclear Zinc Complexes: A Solution to the Entropy Problem in CO2/Epoxide Copolymeriza-tion Catalysis?”. Angew. Chem., Int. Ed. 2013; 52: 9821-9826.

Nakamura A, Anselment TMJ, Claverie J, Goodall B, Jordan RF, Mecking S, Rieger B, Sen A, van Leeu-wen PWNM, Nozaki K: “Ortho-Phosphonebenzenesulfonate: A Superb Ligand for Palladium-Catalyzed Coordination-Insertion Copolymerization of Polar Vinyl Monomers”. Acc. Chem. Res. 2013; 46: 1438-1449.

Philipp M, Rieger B: “Carbonate based electrolytes for lithium sulfur silicon batteries”. Prepr. - Am. Chem. Soc. Div. Energy Fuels. 2013; 58: 881.

Qaroush AK, Al-Hamayda, AS, Khashman YK, Vagin SI, Troll C, Rieger B: “Highly efficient isocyanate-free microwave-assisted synthesis of [6]-oligourea”. Catal. Sci. Technol. 2013; 3: 2221-2226.

Salzinger S, Soller BS, Plikhta, A, Seemann, UB, Herdtweck, E, Rieger B: “Mechanistic Studies on Initia-tion and Propagation of Rare Earth Metal-Mediated Group Transfer Polymerization of Vinylphospho-nates”. J. Am. Chem. Soc. 2013; 135: 13030-13040.

Schoebel A, Lanzinger D, Rieger B: “Polymerization Behavior of C1-Symmetric Metallocenes (M = Zr, Hf): From Ultrahigh Molecular Weight Elastic Polypropylene to Useful Macromonomers”. Organometal-lics. 2013; 32: 427-437.

Zehetmaier PC, Vagin SI, Rieger B: “Functionalization of aliphatic polyketones”. MRS Bull. 2013; 38: 239-244.

Zhang N, Salzinger S, Soller BS, Rieger B: “Rare Earth Metal-Mediated Group-Transfer Polymerization: From Defined Polymer Microstructures to High-Precision Nano-Scaled Objects”. J. Am. Chem. Soc. 2013; 135: 8810-8813.

Zimmer S, Schoebel A, Halbach T, Stohrer J, Rieger, B: “New Curable Propylene Copolymers Contain-ing Tert-Butoxysilane Side Groups”. Macromol. Rapid Commun. 2013; 34: 221-226.

Fachgebiet Industrielle Biokatalyse Prof. Dr. Thomas Brück

Bohnen F, Brück TB: “A critical review of algae process optimization using design of experiment meth-odologies”. JSM Biotechnol. Bioeng. 2013; 1(3): 1015.

Sommer B, Garbe D, Brück TB: “Catalytic modules in non-natural butanol biosynthesis: “Conversion of the key intermediate crotylalcohol to n-butanol via a designed enzyme cascade”. JSM Biotechnol. Bio-eng. 2013; 1(2): 1010.

Sommer B, Garbe D, Schrepfer P, Brück T: “Characterization of a highly thermostable ß-hydroxybutyryl CoA dehydrogenase from Clostridium acetobutylicum ATCC 824”. J. Mol. Catal. B: Enzym. 2013; 98: 138-144.

Brück TB, Bohnen F: “The Biodiesel Dilemma: A techno- and socioeconomic review of EU legislative ac-tions”. JSM Biotechnol. Bioeng. 2013; 1(2): 1009.

Görner C, Häuslein I, Schrepfer P, Eisenreich W, Brück TB: “Targeted engineering of cyclooctat-9-en-7-ol synthase: A stereospecific access to two new, non-natural fusicoccane-type diterpenes”. Chem-CatChem. 2013; 5: 3289-3298.

Zhao C, Brück TB, Lercher JA: “Catalytic deoxygenation of microalgae oil to green hydrocarbons”. Green Chem. 2013; 15: 1720-1739.

Radiochemie und Pharmazeutische Chemie

Lehrstuhl für Pharmazeutische Radiochemie Prof. Dr. Hans-Jürgen Wester

Notni J, Hermann P, Dregely I, Wester HJ: “Convenient synthesis of 68Ga-labeled gadolinium(III) com-plexes: towards bimodal responsive probes for functional imaging with PET/MRI”. Chem. Eur. J. 2013; 19(38): 12602-12606.

Neubauer S, Rechenmacher F, Beer AJ, Curnis F, Pohle K, D'Alessandria C, Wester HJ, Reuning U, Cor-ti A, Schwaiger M, Kessler H: “Selective imaging of the angiogenic relevant integrins α5β1 and αvβ3”. Angew. Chem., Int. Ed. 2013; 52(44): 11656-11659.

Brogsitter C, Schottelius M, Zöphel K, Kotzerke J, Wester HJ: “Twins in spirit: DOTATATE and high-affinity DOTATATE”. Eur. J. Nucl. Med. Mol. Imaging. 2013; 40(11): 1789.

Smolarz K, Krause BJ, Graner FP, Wagner FM, Wester HJ, Sell T, Bacher-Stier C, Fels L, Dinkelborg L, Schwaiger M: “Biodistribution and radiation dosimetry in healthy volunteers of a novel tumour-specific probe for PET/CT imaging: BAY 85-8050”. Eur. J. Nucl. Med. Mol. Imaging. 2013; 40(12): 1861-1868.

Wagner JY, Schwarz K, Schreiber S, Schmidt B, Wester HJ, Schwaiger M, Peschel C, von Schilling C, Scheidhauer K, Keller U: “Myeloablative anti-CD20 radioimmunotherapy +/- high-dose chemotherapy followed by autologous stem cell support for relapsed/refractory B-cell lymphoma results in excellent long-term survival”. Oncotarget. 2013; 4(6): 899-910.

Šimeček J, Hermann P, Havlíčková J, Herdtweck E, Kapp TG, Engelbogen N, Kessler H, Wester HJ, Notni J: “A cyclen-based tetraphosphinate chelator for the preparation of radiolabeled tetrameric bio-conjugates”. Chem. Eur. J. 2013; 19(24): 7748-7757.

Schwarzenböck S, Sachs D, Souvatzoglou M, Schuster T, Nawroth R, Weirich G, Treiber U, Wester HJ, Ziegler S, Schwaiger M, Senekowitsch-Schmidtke R, Krause BJ: “[[¹¹C]choline as a pharmacodynamic marker for docetaxel therapy. Response assessment in a LNCaP prostate cancer xenograft mouse model]”. Nuklearmedizin. 2013; 52(4): 141-147.

Shen Y, Schottelius M, Zelenka K, De Simone M, Pohle K, Kessler H, Wester HJ, Schmutz P, Alberto R: “Orthogonally protected artificial amino acid as tripod ligand for automated peptide synthesis and label-ing with [(99m)Tc(OH(2))(3)(CO)(3)](+)”. Bioconjugate Chem. 2013; 24(1): 26-35.

Šimeček J, Hermann P, Wester HJ, Notni J: “How is ⁶⁸Ga labeling of macrocyclic chelators influenced by metal ion contaminants in 68Ge/68Ga generator eluates?” ChemMedChem. 2013 8(1): 95-103.

Graf N, Herrmann K, Numberger B, Zwisler D, Aichler M, Feuchtinger A, Schuster T, Wester HJ, Sene-kowitsch-Schmidtke R, Peschel C, Schwaiger M, Keller U, Dechow T, Buck AK: “[18F]FLT is superior to [18F]FDG for predicting early response to antiproliferative treatment in high-grade lymphoma in a dose-dependent manner”. Eur. J. Nucl. Med. Mol. Imaging. 2013 40(1): 34-43.

Notni J, Pohle K, Wester HJ: “Be spoilt for choice with radiolabelled RGD peptides: preclinical evaluation of ⁶⁸Ga-TRAP(RGD)₃”. Nucl. Med. Biol. 2013; 40(1): 33-41.

Beyer T, Hacker M, Schubiger A, Virgolini I, Wester HJ: “Nuclear medicine 2013: from status quo to sta-tus go”. Eur. J. Nucl. Med. Mol. Imaging. 2013; 40: 1794-1796.

Laitinen I, Notni J, Pohle K, Rudelius M, Farrell E, Nekolla SG, Henriksen G, Neubauer S, Kessler H, Wester HJ, Schwaiger M: “Comparison of cyclic RGD peptides for αvβ3 integrin detection in a rat model of myocardial infarction”, EJNMMI Research, 2013; 3: 38.

Lebensmittelchemie

Lehrstuhl für Lebensmittelchemie Prof. Dr. Peter Schieberle

Sinuco DC, Steinhaus M, Osorio C, Schieberle P: “Quantitation of the odour-active compounds in Andes berry (Rubus glaucus Benth) fruit using the molecular sensory approach”. Eur. Food Res. Technol. 2013; 236: 373-378.

Craft BD, Chiodini A, Garst J, Granvogl M: “Factors affecting the formation of MCPD esters and glycidyl esters in refined edible oils”. Food Addit. Contam. Part A – Chem. 2013; 30: 46-51.

Crews C, Chiodini A, Granvogl M, Hamlet C, Hrncirik K, Kuhlmann J, Lampen A, Scholz G, Weisshaar R, Wenzl T, Jasti P, Seefelder W: “Analytical approaches for MCPD esters and glycidyl esters in food and biological samples – a review and future perspectives”. Food Addit. Contam. Part A – Chem. 2013; 30: 11-45.

Ewert A, Granvogl M, Schieberle P: “Comparative studies on the generation of acrolein as well as of aroma-active compounds during deep-frying with different edible vegetable fats and oil”. In: Recent Ad-vances in the Analysis of Food and Flavors. Editors: Toth S, Mussinan C. Washington DC, USA: ACS Symposium Series 1098, Am. Chem. Soc., 2013: 129-136.

Conde-Martínez N, Jiménez A, Steinhaus M, Schieberle P, Sinuco D, Osorio C: “Key aroma volatile compounds of gulupa (Passiflora edulis Sims fo edulis) fruit”. Eur. Food Res. Technol. 2013; 236: 1085-1091.

Willner B, Granvogl M, Schieberle P: “Characterization of the key aroma compounds in Bartlett pear brandies by means of the Sensomics concept”. J. Agric. Food Chem. 2013; 61: 9583-9593.

Kiefl J, Pollner G, Schieberle P: “Sensomics analysis of key hazelnut odorants (Corylus avellana L. ‘Ton-da Gentile’) using comprehensive two-dimensional gas chromatography in combination with time-of-flight mass spectrometry (GCxGC-TOF-MS)”. J. Agric. Food Chem. 2013; 61: 5226-5235.

Kiefl J, Schieberle P: “Evaluation of process parameters governing the aroma generation in three hazel-nut cultivars (Corylus avellana L.) by correlating quantitative key odorant profiling with sensory evalua-tion”. J. Agric. Food Chem. 2013; 61: 5236-5244.

Humin J, Steinhaus M, Schieberle P: „Evaluierung chemisch-analytischer Methoden zur Differenzierung von hochwertigem Edelkakao und Konsumkakao (CCN-51) aus Ecuador“. Lebensmittelchemie. 2013; 67: 62.

Steinhaus M, Li JX, Schieberle P „King of fruits“ oder Beleidung der Nase? – Molekulare Einblicke in das Aroma von Durian”. Lebensmittelchemie. 2013; 67: 67.

Steinhaus M, Thomas K, Schieberle P: “Molecular insights into off-flavor formation during pineapple juice processing”. In: Flavour Science. Proceedings from XIII Weurman Flavour Research Symposium. Editors: Ferreira V, Lopez R. Amsterdam: Academic Press, Elsevier, 2013: 87-90.

Kreißl J, Mayr CM, Söllner K, Schieberle P: “Important aroma compounds in salami and correlations with biogenic amines”. In: Flavour Science. Proceedings from XIII Weurman Flavour Research Symposium. Editors: Ferreira V, Lopez R. Amsterdam: Academic Press, Elsevier, 2013: 133-136.

Frank S, Schieberle P: “Influence of the manufacturing process on changes in the concentrations of se-lected key aroma compounds of Dornfelder red wine”. In: Flavour Science. Proceedings from XIII Weur-man Flavour Research Symposium. Editors: Ferreira V, Lopez R. Amsterdam: Academic Press, Elsevier, 2013: 165-168.

Poehlmann S, Schieberle P: “Characterization of the aroma signature of Styrian pumpkin seed oil (Cu-curbita pepo subsp. pepo var. Styriaca) by Molecular Sensory Science”. J. Agric. Food Chem. 2013; 61: 2933-2942.

Grosshauser S, Schieberle P: “Characterization of the key odorants in pan-fried white mushrooms (Agaricus bisporus L.) by means of Molecular Sensory Science: comparison with the raw mushroom tis-sue”. J. Agric. Food Chem. 2013; 61: 3804-3813.

Blank I, Davidek T, Novotny O, Schieberle P, Granvogl M: “Use of oxazolines as aroma/flavour precur-sors”. PCT Int. Appl. 2013; WO 2013143904 A1 20131003.

Frank S, Linder K, Fritsche L, Hege MA, Kullmann S, Krzeminski A, Fritsche A, Schieberle P, Somoza V, Hinrichs J, Veit R, Preissl H: “Olive oil aroma extract modulates cerebral blood flow in gustatory brain ar-eas in humans”. Am. J. Clin. Nutr. 2013; 98: 1360-1366.

Hammer M, Schieberle P: “Model studies on the key aroma compounds formed by an oxidative degra-dation of ω-3 fatty acids initiated by either copper(II) ions or lipoxygenase”. J. Agric. Food Chem. 2013; 61: 10891-10900.

Langos D, Granvogl M, Schieberle P: “Characterization of the key aroma compounds in two Bavarian wheat beers by means of the Sensomics approach”. J. Agric. Food Chem. 2013; 61: 11303-11311.

Schroepfer M, Czerny M, Schulz H, Schieberle P: “The odor of leather”. J. Am. Leather Chem. As. 2013; 108: 94-107.

Elektronenmikroskopie

Fachgebiet für Elektronenmikroskopie Prof. Dr. S. Weinkauf

Peschek J, Braun N, Rohrberg J, Back KC, Kriehuber T, Kastenmüller A, Weinkauf S, Buchner J: “Regu-lated structural transitions unleash the chaperone activity of αB-crystallin”. Proc. Natl. Acad. Sci. USA. 2013; 110(40): 3780-3789.

Institut für Wasserchemie und Chemische Balneologie

Lehrstuhl für Analytische Chemie Prof. Dr. Reinhard Nießner, Prof. Dr. Dietmar Knopp, PD Dr. Christoph Haisch, PD Dr. Thomas Baumann

Yang D, Zhou H, Niessner R, Ying Y, Haisch C: “Surface – Enhanced Raman Scattering for Quantitative Detection of Ethyl Carbamate in Alcoholic Beverages”. Anal. Bioanal. Chem. 2013; 405: 9419-9425.

Grob B, Burtscher H, Niessner R: “Charging of Ultrafine Aerosol Particles by an Ozone – free Indirect UV – Photocharger”. Aerosol Sci. Technol. 2013; 47: 1325-1333.

Ivleva N, Huckele S, Weinzierl B, Niessner R, Haisch C, Baumann T: “Identification and Characterization of Individual Airborne Volcanic Ash Particles by Raman Microspectroscopy”. Anal. Bioanal. Chem. 2013; 405: 9071-9084.

Tang D, Liu B, Niessner R, Li P, Knopp D: “Target – Induced Displacement Reaction Accompanying with Cargo Release from Magnetic Mesoporous Silica Nanocontainers for Fluorescence Immunoassay”. Anal. Chem. 2013; 85: 10589-10596.

Imhof H, Ivleva N, Schmid J, Niessner R, Laforsch C: “Beyond the Ocean: Contamination of a Subalpine Lake with Plastic Particles”. Current Biology. 2013; 23: R867-R868.

Beloglazova NV, Shmelin PS, Speranskaya ES, Lucas B, Helmbrecht C, Knopp D, Niessner R, De Sae-ger S, Goryacheva IYu: “Quantum Dot Loaded Liposomes as New Luminescent Labels for Immunoas-say”. Anal. Chem. 2013; 85: 7197-7204.

Oswald S, Karsunke XYZ, Dietrich R, Märtlbauer E, Niessner R, Knopp D: “Automated Regenerable Mi-croarray – Based Immunoassay for Rapid Parallel Quantification of Mycotoxins in Cereals”. Anal. Bio-anal. Chem. 2013; 405: 6405-6415.

Szkola A, Campbell K, Elliott CT, Niessner R, Seidel M: “Automated, High Performance, Flow – through Chemiluminescence Microarray for the Multiplexed Detection of Phycotoxins”. Anal. Chim. Acta. 2013; 797: 211-218.

Schwarzmeier K, Knauer M, Ivleva N, Niessner R, Haisch C: “Bioaerosol Analysis Based on a Label-free Microarray Readout Method by SERS”. Anal. Bioanal. Chem. 2013; 405: 5387-5392.

Wutz K, Meyer V, Krol P, Wacheck S, Gareis M, Noelting C, Soutschek E, Boecher O, Niessner R, Seidel M: “New Route for Fast Detection of Zoonoses Antibodies in Sera of Slaughtered Pigs by Means of Flow-through Chemiluminescence Immunochips on Example of Hepatitis E Virus”. Anal. Chem. 2013; 85: 5279-5285.

Li D, Ying Y, Wu J, Niessner R, Knopp D: “Comparison of Monomeric and Polymeric Horseradish Perox-idase as Labels in Competitive ELISA for Small Molecule Detection”. Microchim. Acta. 2013; 80: 711-717.

Moldanova J, Fridell E, Winnes H, Holmin-Fridell S, Bolnan J, Jedyuska A, Tishkova V, Demirdjian B, Joulie S, Bladt H, Ivleva N, Niessner R: “Physical and Chemical Characterisation of PM Emissions from Two Ships Operating in European Emission Control Areas”. Aerosol Measurement Technology. 2013; 6: 3577-3596.

Hübner M, Wutz K, Szkola A, Niessner R, Seidel M: “A Glyco – Chip for the Rapid Detection of Ricin by an Automated Chemiluminescence Read-out System”. Anal. Sciences. 2013; 29: 461-466.

Tang D, Hou L, Niessner R, Xu M, Gao Z, Knopp D: “Multiplexed Electrochemical Immunoassay of Can-cer Biomarkers Using Distinguishable Metal Sulfide Quantum Dot Nanolabels and Trifunctionalized Magnetic Beads”. Biosens. Bioelectron. 2013; 46: 37-43.

Zhang B, Tang D, Goryacheva I, Niessner R, Knopp D: “Anodic Stripping Voltammetric Immunoassay for Ultrasensitive Detection of Low – Abundance Proteins Using Quantum Dots – Aggregated Hollow Micro-spheres”. Chem. Eur. J. 2013; 19: 2496-2503.

Yang DT, Mirescu NE, Zhou HB, Leopold N, Chis V, Oltean M, Ying YB, Haisch C: “DFT Study and Quantitative Detection by Surface – Enhanced Raman Scattering (SERS) of Ethyl Carbamate”. J. Raman Spectrosc. 2013; 44(11): 1491-1496.

Abraham P, Barnikol S, Baumann T, Kühn M, Ivleva NP, Schaumann G: “Sorption of Silver Nanoparticles to Environmental and Model Surfaces”. Environ. Sci. Technol. 2013; 47: 5083-5091.

Nestle N, Morris R, Baumann T: “Environmental NMR: Magnetic Resonance Imaging”. eMagRes 2. 2013; doi: //10.1002/9780470034590.emrstm 1349.