Gold(
Intermediate species formed during CO2 methanation over Rh/Al2O3 and Rh/SiO2 catalysts.
}}, author = {{Martin, Natalia M. and Hemmingsson, Felix and Wang, Xueting and Merte, Lindsay R. and Hejral, Uta and Gustafson, Johan and Skoglundh, Magnus and Meira, Debora Motta and Dippel, Ann-Christin and Gutowski, Olof and Bauer, Matthias and Carlsson, Per-Anders}}, issn = {{2044-4753}}, journal = {{Catalysis Science & Technology}}, keywords = {{Catalysis}}, number = {{10}}, pages = {{2686--2696}}, publisher = {{Royal Society of Chemistry (RSC)}}, title = {{{Structure–function relationship during CO2 methanation over Rh/Al2O3 and Rh/SiO2 catalysts under atmospheric pressure conditions}}}, doi = {{10.1039/c8cy00516h}}, volume = {{8}}, year = {{2018}}, } @article{34306, abstract = {{The tautomeric equilibrium of 1-lithium-1,2,3-triazolate (1Li-TR) and 2-lithium-1,2,3-triazolate (2Li-TR) is studied by X-ray diffraction, NMR spectroscopy and molecular dynamics simulations.
}}, author = {{Pulst, Martin and Elgabarty, Hossam and Sebastiani, Daniel and Kressler, Jörg}}, issn = {{1144-0546}}, journal = {{New Journal of Chemistry}}, keywords = {{Materials Chemistry, General Chemistry, Catalysis}}, number = {{4}}, pages = {{1430--1435}}, publisher = {{Royal Society of Chemistry (RSC)}}, title = {{{The annular tautomerism of lithium 1,2,3-triazolate}}}, doi = {{10.1039/c6nj03732a}}, volume = {{41}}, year = {{2017}}, } @article{35705, author = {{Bestgen, Sebastian and Seidl, Carmen and Wiesner, Thomas and Zimmer, Andreas and Falk, Martina and Köberle, Beate and Austeri, Martina and Paradies, Jan and Bräse, Stefan and Schepers, Ute and Roesky, Peter W.}}, issn = {{0947-6539}}, journal = {{Chemistry - A European Journal}}, keywords = {{General Chemistry, Catalysis, Organic Chemistry}}, number = {{26}}, pages = {{6459--6459}}, publisher = {{Wiley}}, title = {{{Inside Back Cover: Double-Strand DNA Breaks Induced by Paracyclophane Gold(I) Complexes (Chem. Eur. J. 26/2017)}}}, doi = {{10.1002/chem.201700517}}, volume = {{23}}, year = {{2017}}, } @article{41045, abstract = {{CO2 methanation over Rh/Al2O3, Rh/CeO2 and Ni/CeO2 at 350 °C highlighting the different surface speciation during reaction.
}}, author = {{Martin, Natalia M. and Velin, Peter and Skoglundh, Magnus and Bauer, Matthias and Carlsson, Per-Anders}}, issn = {{2044-4753}}, journal = {{Catalysis Science & Technology}}, keywords = {{Catalysis}}, number = {{5}}, pages = {{1086--1094}}, publisher = {{Royal Society of Chemistry (RSC)}}, title = {{{Catalytic hydrogenation of CO2 to methane over supported Pd, Rh and Ni catalysts}}}, doi = {{10.1039/c6cy02536f}}, volume = {{7}}, year = {{2017}}, } @article{63956, abstract = {{The synthesis of novel robust and stable iridium-based immobilized catalysts on silica-polymer hybrid materials (Si-PB-Ir) is described. These catalysts are characterized by a combination of 1D P-31 CP-MAS and 2D P-31-H-1 HETCOR and J-resolved multinuclear solid state NMR experiments. Different binding situations such as singly and multiply coordinated phosphines are identified. Density functional theory (DFT) calculations are performed to corroborate the interpretation of the experimental NMR data, in order to propose a structural model of the heterogenized catalysts. Finally, the catalytic activity of the Si-PB-Ir catalysts is investigated for the hydrogenation of styrene employing para-enriched hydrogen gas.}}, author = {{Gutmann, Torsten and Alkhagani, S. and Rothermel, N. and Limbach, H. H. and Breitzke, H. and Buntkowsky, G.}}, issn = {{0942-9352}}, journal = {{Zeitschrift Fur Physikalische Chemie-International Journal of Research in Physical Chemistry & Chemical Physics}}, keywords = {{Chemistry, dynamic nuclear-polarization, solid-state nmr, DFT, heterogeneous catalysis, hydrido complexes, hydrogenation, immobilized catalyst, inorganic hybrid, iridium, materials, mesoporous, molecular-orbital methods, PHIP, phosphine complexes, reusable catalysts, silica, solid-state-NMR, wilkinsons catalyst}}, number = {{3}}, pages = {{653–669}}, title = {{{P-31-Solid-State NMR Characterization and Catalytic Hydrogenation Tests of Novel heterogenized Iridium-Catalysts}}}, doi = {{10.1515/zpch-2016-0837}}, volume = {{231}}, year = {{2017}}, } @article{35710, author = {{Tussing, Sebastian and Kaupmees, Karl and Paradies, Jan}}, issn = {{0947-6539}}, journal = {{Chemistry – A European Journal}}, keywords = {{General Chemistry, Catalysis, Organic Chemistry}}, number = {{22}}, pages = {{7302--7302}}, publisher = {{Wiley}}, title = {{{Inside Cover: Structure–Reactivity Relationship in the Frustrated Lewis Pair (FLP)‐Catalyzed Hydrogenation of Imines (Chem. Eur. J. 22/2016)}}}, doi = {{10.1002/chem.201601558}}, volume = {{22}}, year = {{2016}}, } @article{64047, abstract = {{A novel strategy for the immobilization of Wilkinson’s catalyst on silica nanoparticles is presented, employing pyridyl linkers as anchoring groups. The coordination binding of the catalyst to the pyridyl linker via ligand exchange of the trans-phosphine group is verified by 1 D and 2 D solid-state NMR spectroscopy. Catalytic activities are monitored by GC employing the hydrogenation of styrene as model reaction, and the leaching properties as well as the robustness of the catalyst are investigated. The resulting immobilized catalyst shows high catalytic activity, which is within a factor of three comparable to the homogeneous catalyst, and excellent stability in leaching tests. Finally, it is efficient to produce hyperpolarization in solution by employing parahydrogen-enriched hydrogen gas for hydrogenation.}}, author = {{Srour, Mohamad and Hadjiali, Sara and Sauer, Grit and Brunnengräber, Kai and Breitzke, Hergen and Xu, Yeping and Weidler, Heiko and Limbach, Hans-Heinrich and Gutmann, Torsten and Buntkowsky, Gerd}}, journal = {{ChemCatChem}}, keywords = {{heterogeneous catalysis, hydrogenation, immobilization, phosphane ligands, rhodium}}, number = {{21}}, pages = {{3409–3416}}, title = {{{Synthesis and Solid-State NMR Characterization of a Robust, Pyridyl-Based Immobilized Wilkinson’s Type Catalyst with High Catalytic Performance}}}, doi = {{10.1002/cctc.201600882}}, volume = {{8}}, year = {{2016}}, } @article{41059, author = {{Busser, G. Wilma and Mei, Bastian and Weide, Philipp and Vesborg, Peter C. K. and Stührenberg, Kai and Bauer, Matthias and Huang, Xing and Willinger, Marc-Georg and Chorkendorff, Ib and Schlögl, Robert and Muhler, Martin}}, issn = {{2155-5435}}, journal = {{ACS Catalysis}}, keywords = {{Catalysis, General Chemistry}}, number = {{9}}, pages = {{5530--5539}}, publisher = {{American Chemical Society (ACS)}}, title = {{{Cocatalyst Designing: A Regenerable Molybdenum-Containing Ternary Cocatalyst System for Efficient Photocatalytic Water Splitting}}}, doi = {{10.1021/acscatal.5b01428}}, volume = {{5}}, year = {{2015}}, } @article{41053, author = {{Sinha, Woormileela and Sommer, Michael G. and Deibel, Naina and Ehret, Fabian and Bauer, Matthias and Sarkar, Biprajit and Kar, Sanjib}}, issn = {{1433-7851}}, journal = {{Angewandte Chemie International Edition}}, keywords = {{General Chemistry, Catalysis}}, number = {{46}}, pages = {{13769--13774}}, publisher = {{Wiley}}, title = {{{Experimental and Theoretical Investigations of the Existence of CuII, CuIII, and CuIVin Copper Corrolato Complexes}}}, doi = {{10.1002/anie.201507330}}, volume = {{54}}, year = {{2015}}, } @article{63963, abstract = {{A novel heterogeneous dirhodium catalyst has been synthesized. This stable catalyst is constructed from dirhodium acetate dimer (Rh2(OAc)4) units, which are covalently linked to amine- and carboxyl-bifunctionalized mesoporous silica (SBA-15NH2COOH). It shows good efficiency in catalyzing the cyclopropanation reaction of styrene and ethyl diazoacetate (EDA) forming cis- and trans-1-ethoxycarbonyl-2-phenylcyclopropane. To characterize the structure of this catalyst and to confirm the successful immobilization, heteronuclear solid-state NMR experiments have been performed. The high application potential of dynamic nuclear polarization (DNP) NMR for the analysis of binding sites in this novel catalyst is demonstrated. Signal-enhanced 13C CP MAS and 15N CP MAS techniques have been employed to detect different carboxyl and amine binding sites in natural abundance on a fast time scale. The interpretation of the experimental chemical shift values for different binding sites has been corroborated by quantum chemical calculations on dirhodium model complexes.}}, author = {{Gutmann, Torsten and Liu, Jiquan and Rothermel, Niels and Xu, Yeping and Jaumann, Eva and Werner, Mayke and Breitzke, Hergen and Sigurdsson, Snorri T. and Buntkowsky, Gerd}}, journal = {{Chemistry A European Journal}}, keywords = {{heterogeneous catalysis, immobilized catalyst, dynamic nuclear polarization, hyperpolarization, NMR spectroscopy}}, number = {{9}}, pages = {{3798–3805}}, publisher = {{WILEY-VCH Verlag}}, title = {{{Natural Abundance 15N NMR by Dynamic Nuclear Polarization: Fast Analysis of Binding Sites of a Novel Amine-Carboxyl-Linked Immobilized Dirhodium Catalyst}}}, doi = {{10.1002/chem.201405043}}, volume = {{21}}, year = {{2015}}, } @article{41057, author = {{Dehe, Daniel and Wang, Lei and Müller, Melanie K. and Dörr, Gunder and Zhou, Zhou and Klupp-Taylor, Robin N. and Sun, Yu and Ernst, Stefan and Hartmann, Martin and Bauer, Matthias and Thiel, Werner R.}}, issn = {{1867-3880}}, journal = {{ChemCatChem}}, keywords = {{Inorganic Chemistry, Organic Chemistry, Physical and Theoretical Chemistry, Catalysis}}, number = {{1}}, pages = {{127--136}}, publisher = {{Wiley}}, title = {{{A Rhodium Triphenylphosphine Catalyst for Alkene Hydrogenation Supported on Neat Superparamagnetic Iron Oxide Nanoparticles}}}, doi = {{10.1002/cctc.201402615}}, volume = {{7}}, year = {{2014}}, } @article{41222, author = {{Mellmann, Dörthe and Barsch, Enrico and Bauer, Matthias and Grabow, Kathleen and Boddien, Albert and Kammer, Anja and Sponholz, Peter and Bentrup, Ursula and Jackstell, Ralf and Junge, Henrik and Laurenczy, Gábor and Ludwig, Ralf and Beller, Matthias}}, issn = {{0947-6539}}, journal = {{Chemistry – A European Journal}}, keywords = {{General Chemistry, Catalysis, Organic Chemistry}}, number = {{42}}, pages = {{13589--13602}}, publisher = {{Wiley}}, title = {{{Base‐Free Non‐Noble‐Metal‐Catalyzed Hydrogen Generation from Formic Acid: Scope and Mechanistic Insights}}}, doi = {{10.1002/chem.201403602}}, volume = {{20}}, year = {{2014}}, } @article{41227, author = {{Klein, Johannes E. M. N. and Miehlich, Burkhard and Holzwarth, Michael S. and Bauer, Matthias and Milek, Magdalena and Khusniyarov, Marat M. and Knizia, Gerald and Werner, Hans-Joachim and Plietker, Bernd}}, issn = {{1433-7851}}, journal = {{Angewandte Chemie International Edition}}, keywords = {{General Chemistry, Catalysis}}, number = {{7}}, pages = {{1790--1794}}, publisher = {{Wiley}}, title = {{{The Electronic Ground State of [Fe(CO)3(NO)]−: A Spectroscopic and Theoretical Study}}}, doi = {{10.1002/anie.201309767}}, volume = {{53}}, year = {{2014}}, } @article{41233, author = {{Suljoti, Edlira and Garcia-Diez, Raul and Bokarev, Sergey I. and Lange, Kathrin M. and Schoch, Roland and Dierker, Brian and Dantz, Marcus and Yamamoto, Kenji and Engel, Nicholas and Atak, Kaan and Kühn, Oliver and Bauer, Matthias and Rubensson, Jan-Erik and Aziz, Emad F.}}, issn = {{1433-7851}}, journal = {{Angewandte Chemie International Edition}}, keywords = {{General Chemistry, Catalysis}}, number = {{37}}, pages = {{9841--9844}}, publisher = {{Wiley}}, title = {{{Direct Observation of Molecular Orbital Mixing in a Solvated Organometallic Complex}}}, doi = {{10.1002/anie.201303310}}, volume = {{52}}, year = {{2013}}, }