Bannwarth C - Search Results

1

Photochemical Deracemization of 4,7-Diaza-1-isoindolinones by Unidirectional Hydrogen Atom Shuttling.

Freund P, Pauls M, Babushkina D, Pickl T, Bannwarth C, Bach T. Freund P, et al. Among authors: bannwarth c. J Am Chem Soc. 2025 Jan 15;147(2):1434-1439. doi: 10.1021/jacs.4c16053. Epub 2024 Dec 30. J Am Chem Soc. 2025. PMID: 39752316 Free PMC article.

2

Photochemical Deracemization of Primary Allene Amides by Triplet Energy Transfer: A Combined Synthetic and Theoretical Study.

Plaza M, Großkopf J, Breitenlechner S, Bannwarth C, Bach T. Plaza M, et al. Among authors: bannwarth c. J Am Chem Soc. 2021 Jul 28;143(29):11209-11217. doi: 10.1021/jacs.1c05286. Epub 2021 Jul 19. J Am Chem Soc. 2021. PMID: 34279085

3

Photochemical Deracemization of Chiral Alkenes via Triplet Energy Transfer.

Kratz T, Steinbach P, Breitenlechner S, Storch G, Bannwarth C, Bach T. Kratz T, et al. Among authors: bannwarth c. J Am Chem Soc. 2022 Jun 15;144(23):10133-10138. doi: 10.1021/jacs.2c02511. Epub 2022 Jun 6. J Am Chem Soc. 2022. PMID: 35658423

4

Multifaceted View on the Mechanism of a Photochemical Deracemization Reaction.

Kutta RJ, Großkopf J, van Staalduinen N, Seitz A, Pracht P, Breitenlechner S, Bannwarth C, Nuernberger P, Bach T. Kutta RJ, et al. Among authors: bannwarth c. J Am Chem Soc. 2023 Feb 1;145(4):2354-2363. doi: 10.1021/jacs.2c11265. Epub 2023 Jan 20. J Am Chem Soc. 2023. PMID: 36660908

5

Photoswitchable Quadruple Hydrogen-Bonding Motif.

Tang B, Pauls M, Bannwarth C, Hecht S. Tang B, et al. Among authors: bannwarth c. J Am Chem Soc. 2024 Jan 10;146(1):45-50. doi: 10.1021/jacs.3c10401. Epub 2023 Nov 30. J Am Chem Soc. 2024. PMID: 38033296

6

Catalytic deracemization of chiral allenes by sensitized excitation with visible light.

Hölzl-Hobmeier A, Bauer A, Silva AV, Huber SM, Bannwarth C, Bach T. Hölzl-Hobmeier A, et al. Among authors: bannwarth c. Nature. 2018 Dec;564(7735):240-243. doi: 10.1038/s41586-018-0755-1. Epub 2018 Dec 12. Nature. 2018. PMID: 30542163

7

Enantiotopos-selective C-H oxygenation catalyzed by a supramolecular ruthenium complex.

Frost JR, Huber SM, Breitenlechner S, Bannwarth C, Bach T. Frost JR, et al. Among authors: bannwarth c. Angew Chem Int Ed Engl. 2015 Jan 7;54(2):691-5. doi: 10.1002/anie.201409224. Epub 2014 Nov 20. Angew Chem Int Ed Engl. 2015. PMID: 25413591

8

Biomolecular Structure Information from High-Speed Quantum Mechanical Electronic Spectra Calculation.

Seibert J, Bannwarth C, Grimme S. Seibert J, et al. Among authors: bannwarth c. J Am Chem Soc. 2017 Aug 30;139(34):11682-11685. doi: 10.1021/jacs.7b05833. Epub 2017 Aug 18. J Am Chem Soc. 2017. PMID: 28799760

9

A generally applicable atomic-charge dependent London dispersion correction.

Caldeweyher E, Ehlert S, Hansen A, Neugebauer H, Spicher S, Bannwarth C, Grimme S. Caldeweyher E, et al. Among authors: bannwarth c. J Chem Phys. 2019 Apr 21;150(15):154122. doi: 10.1063/1.5090222. J Chem Phys. 2019. PMID: 31005066

10

Ultra-fast computation of electronic spectra for large systems by tight-binding based simplified Tamm-Dancoff approximation (sTDA-xTB).

Grimme S, Bannwarth C. Grimme S, et al. Among authors: bannwarth c. J Chem Phys. 2016 Aug 7;145(5):054103. doi: 10.1063/1.4959605. J Chem Phys. 2016. PMID: 27497535

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