Organic and Biomolecular Chemistry
Organic and Biomolecular Chemistry
4 years ago

Computational characterization of the mechanism for the light-driven catalytic trichloromethylation of acylpyridines

Computational characterization of the mechanism for the light-driven catalytic trichloromethylation of acylpyridines
Feliu Maseras, Victor M. Fernandez-Alvarez
DFT and DFT/MM calculations are applied to a photocatalytic enantioselective reaction and shown to be able to characterize the mechanism.

Publisher URL: http://feeds.rsc.org/~r/rss/OB/~3/gMkC_Zwt9gU/C7OB01826F

DOI: 2017/OB/C7OB01826F

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