Scientific Publications

Runikhina, S. A.; Afanasyev, O. I.; Biriukov, K.; Perekalin, D. S.; Klussmann, M.; Chusov, D.: Aldehydes as Alkylating Agents for Ketones. Chemistry – A European Journal 25 (71), pp. 16225 - 16229 (2019)

Peil, S.; Fürstner, A.: Mechanistic Divergence in the Hydrogenative Synthesis of Furans and Butenolides: Ruthenium Carbenes Formed by gem‐Hydrogenation or through Carbophilic Activation of Alkynes. Angewandte Chemie, International Edition 58 (51), pp. 18476 - 18481 (2019)

Pantazis, D. A.: First-Principles Calculation of Transition Metal Hyperfine Coupling Constants with the Strongly Constrained and Appropriately Normed (SCAN) Density Functional and its Hybrid Variants. Magnetochemistry 5 (4), 69 (2019)

Gómez‐Palomino, A.; Cornella, J.: Selective Late‐Stage Sulfonyl Chloride Formation from Sulfonamides Enabled by Pyry‐BF₄. Angewandte Chemie, International Edition 58 (50), pp. 18235 - 18239 (2019)

Farès, C.; Lingnau, J. B.; Wirtz, C.; Sternberg, U.: Conformational Investigations in Flexible Molecules Using Orientational NMR Constraints in Combination with ³J-Couplings and NOE Distances. Molecules 24 (23), 4417 (2019)

Bartsch, L.; Bartel, M.; Gigante, A.; Iglesias‐Fernández, J.; Ruiz-Blanco, Y. B.; Beuck, C.; Briels, J.; Toetsch, N.; Bayer, P.; Sanchez-Garcia, E. et al.; Ottmann, C.; Schmuck, C.: Multivalent Ligands with Tailor‐Made Anion Binding Motif as Stabilizers of Protein–Protein Interactions. Chembiochem 20 (13), pp. 2921 - 2926 (2019)

Chang, H.-C.; Lin, Y.-H.; Werlé, C.; Neese, F.; Lee, W.-Z.; Bill, E.; Ye, S.: Conversion of a Fleeting Open‐Shell Iron Nitride into an Iron Nitrosyl. Angewandte Chemie, International Edition 58 (49), pp. 17589 - 17593 (2019)

Mathe, Z.; Pantazis, D. A.; Lee, H. B.; Gnewkow, R.; Van Kuiken, B. E.; Agapie, T.; DeBeer, S.: Calcium Valence-to-Core X-ray Emission Spectroscopy: A Sensitive Probe of Oxo Protonation in Structural Models of the Oxygen-Evolving Complex. Inorganic Chemistry 58 (23), pp. 16292 - 16301 (2019)

Sharma, M. K.; Blomeyer, S.; Neumann, B.; Stammler, H.-G.; van Gastel, M.; Hinz, A.; Ghadwal, R. S.: Crystalline Divinyldiarsene Radical Cations and Dications. Angewandte Chemie, International Edition 58 (49), pp. 17599 - 17603 (2019)

Shmool, T. A.; Woodhams, P. J.; Leutzsch, M.; Stephens, A. D.; Gaimann, M. U.; Mantle, M. D.; Kaminski Schierle, G. S.; van der Walle, C. F.; Zeitler, J. A.: Observation of high-temperature macromolecular confinement in lyophilised protein formulations using terahertz spectroscopy. International Journal of Pharmaceutics: X 1, 100022 (2019)

Huang, L.; Gu, Y.; Fürstner, A.: Iron-Catalyzed Reactions of 2‐Pyridone Derivatives: 1,6‐Addition and Formal Ring Opening/Cross Coupling. Chemistry – An Asian Journal 14 (22), pp. 4017 - 4023 (2019)

Tanwar, L.; Börgel, J.; Ritter, T.: Synthesis of Benzylic Alcohols by C–H Oxidation. Journal of the American Chemical Society 141 (45), pp. 17983 - 17988 (2019)

Altun, A.; Neese, F.; Bistoni, G.: HFLD: A Non-empirical London Dispersion Corrected Hartree-Fock Method for the Quantification and Analysis of Noncovalent Interaction Energies of Large Molecular Systems. Journal of Chemical Theory and Computation 15 (11), pp. 5894 - 5907 (2019)

Albert, R.; Urbanczyk, R.; Felderhoff, M.: Thermal conductivity measurements of magnesium hydride powder beds under operating conditions for heat storage applications. International Journal of Hydrogen Energy 44 (55), pp. 29273 - 29281 (2019)

Stein, C. J.; Pantazis, D. A.; Krewald, V.: Orbital Entanglement Analysis of Exchange-Coupled Systems. The Journal of Physical Chemistry Letters 10 (21), pp. 6762 - 6770 (2019)

Neumann, C. N.; Rozeveld, S. J.; Yu, M.; Rieth, A. J.; Dincă, M.: Metal–Organic Framework-Derived Guerbet Catalyst Effectively Differentiates between Ethanol and Butanol. Journal of the American Chemical Society 141 (44), pp. 17477 - 17481 (2019)

Bingre, R.; Losch, P.; Megías‐Sayago, C.; Vincent, B.; Pale, P.; Nguyen, P.; Louis, B.: PFG‐NMR as a Tool for Determining Self‐Diffusivities of Various Probe Molecules through H‐ZSM‐5 Zeolites. ChemPhysChem 20 (21), pp. 2874 - 2880 (2019)

Sang, R.; Korkis, S. E.; Su, W.; Ye, F.; Engl, P. S.; Berger, F.; Ritter, T.: Site‐selective C−H Oxygenation via Aryl Sulfonium Salts. Angewandte Chemie, International Edition 58 (45), pp. 16161 - 16166 (2019)

DeRosha, D. E.; Chilkuri, V. G.; Van Stappen, C.; Bill, E.; Mercado, B. Q.; DeBeer, S.; Neese, F.; Holland, P. L.: Planar three-coordinate iron sulfide in a synthetic [4Fe-3S] cluster with biomimetic reactivity. Nature Chemistry 11 (11), pp. 1019 - 1025 (2019)

Kim, J.; Sarma, B. B.; Andrés, E.; Pfänder, N.; Concepción, P.; Prieto, G.: Surface Lewis Acidity of Periphery Oxide Species as a General Kinetic Descriptor for CO₂ Hydrogenation to Methanol on Supported Copper Nanoparticles. ACS Catalysis 9 (11), pp. 10409 - 10417 (2019)