Journal Article (5025)
2023
Journal Article
Korber, J. N.; Wille, C.; Leutzsch, M.; Fürstner, A. From the Glovebox to the Benchtop: Air-Stable High Performance Molybdenum Alkylidyne Catalysts for Alkyne Metathesis. Journal of the American Chemical Society 2023, 145, 26993–27009.
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Gunnarson, A.; ; ; ; Schüth, F.; Stability Investigations on a Pt@HGS Catalyst as a Model Material for Fuel Cell Applications: The Role of the Local PH. Angewandte Chemie International Edition 2023, 62, e202311780.
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Bai, Z.; Lansbergen, B.; Ritter, T. Bicyclopentylation of Alcohols with Thianthrenium Reagents. Journal of the American Chemical Society 2023, 145, 25954–25961.
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Drosou, M.; ; ; ; Pantazis, D. A.; ; Structure and Flexibility of Copper-Modified DNA G-Quadruplexes Investigated by 19F ENDOR Experiments at 34 GHz. Chemistry – A European Journal 2023, 29, e202302527.
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Bilican, A.; Sharma, P.; Tran, N. K.; Weidenthaler, C.; Schmidt, W. Superfast Synthesis of Carbon Xerogels. ACS Omega 2023, 8, 45599–45605.
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Kim, J.; Müller, S.; Ritter, T. Synthesis of α-Branched Enones Via Chloroacylation of Terminal Alkenes. Angewandte Chemie International Edition 2023, 62, e202309498.
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Moon, H. W.; Wang, F.; Bhattacharyya, K.; Planas, O.; Leutzsch, M.; Nöthling, N.; Auer, A. A.; Cornella, J. Mechanistic Studies on the Bismuth-Catalyzed Transfer Hydrogenation of Azoarenes. Angewandte Chemie International Edition 2023, 62, e202313578.
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Goddard, R.; ; Crystal Structure and Antimycobacterial Evaluation of 2-(Cyclohexylmethyl)-7-Nitro-5-(Trifluoromethyl)- Benzo[d]Isothiazol-3(2H)-One. Acta Crystallographica , Section E: Crystallographic Communications 2023, 79, 1194–1198.
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Pantazis, D. A.; Conformational Energies of Reference Organic Molecules: Benchmarking of Common Efficient Computational Methods against Coupled Cluster Theory. Journal of Computer-Aided Molecular Design 2023, 37, 607–656.
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Drosou, M.; ; ; Neese, F.; ; Pantazis, D. A.; Nature of S-States in the Oxygen-Evolving Complex Resolved by High-Energy Resolution Fluorescence Detected X-Ray Absorption Spectroscopy. Journal of the American Chemical Society 2023, 145, 25579–25594.
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Tsuruta, T.; Spinnato, D.; Moon, H. W.; Leutzsch, M.; Cornella, J. Bi-Catalyzed Trifluoromethylation of C(Sp2)–H Bonds under Light. Journal of the American Chemical Society 2023, 145, 25538–25544.
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Neese, F.; ; ; Cluster-in-Molecule Approach with Explicitly Correlated Methods for Large Molecules. Journal of Chemical Theory and Computation 2023, 19, 8076–8089.
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Hamad, A.; Mrozowicz, M.; Xie, Y.; Ritter, T. Regioselective Double C–H Functionalization of Arenes Via Aryl Thianthrenium Salt Analogues. Synlett 2023, 34, A-E.
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Wang, Z.; ; ; Unraveling the Valence State and Reactivity of Copper Centers in Membrane-Bound Particulate Methane Monooxygenase. Journal of the American Chemical Society 2023, 145, 25304–25317.
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Qiu, G.; The Intrinsic Barrier Width and Its Role in Chemical Reactivity. ACS Central Science 2023, 9, 2129–2137.
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Neese, F.; Bursch, M. Assessment of DLPNO-MP2 Approximations in Double-Hybrid DFT. Journal of Chemical Theory and Computation 2023, 19, 7695–7703.
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Wang, Z.; When do Tripdoublet States Fluoresce? A Theoretical Study of Copper(II) Porphyrin. Frontiers in Chemistry 2023, 11, 1259016.
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Gallus, S.; Weidenthaler, C. Systematic in Situ Investigation of the Formation of NH3 Cracking Catalysts from Precursor Perovskites ABO3 (A=La,Ca,Sr and B=Fe,Co,Ni) and their Catalytic Performance. ChemCatChem 2023, 15, e202300947.
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Sirohiwal, A.; Pantazis, D. A. Reaction Center Excitation in Photosystem II: From Multiscale Modeling to Functional Principles. Accounts of Chemical Research 2023, 56, 2921–2932.
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SantaLucia, D. J.; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; ; Pantazis, D. A.; ; ; ; ; ; ; ; ; Neese, F.; ; Reactive High-Spin Iron(IV)-Oxo Sites through Dioxygen Activation in a Metal–Organic Framework. Science 2023, 382, 547–553.
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