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A DFT Study of the Water-Assisted Intramolecular Proton Transfer in the Tautomers of Adenine

โœ Scribed by Gu, Jiande; Leszczynski, Jerzy


Book ID
111885195
Publisher
American Chemical Society
Year
1999
Tongue
English
Weight
102 KB
Volume
103
Category
Article
ISSN
1089-5639

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## Abstract DFT and Moller Plesset (MP2) calculations were applied to study of isomery scheme in formazan. Formazan that can be presented by three tautomers and eight isomers has various applications in dyes, complexes, and biochemistry. The structures of its isomers and related transition states w