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Nanopools Governing Proton Transfer in Diametrical Ways in the Ground and Excited State

โœ Scribed by Mukhopadhyay, Madhuri; Mandal, Abhijit; Misra, Ramprasad; Banerjee, Debi; Bhattacharyya, Shankar Prasad; Mukherjee, Samaresh

Book ID
126846542
Publisher
American Chemical Society
Year
2009
Tongue
English
Weight
833 KB
Volume
113
Category
Article
ISSN
0022-3654

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Ground and excited state intramolecular
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โœ Xiaofeng Duan; Steve Scheiner ๐Ÿ“‚ Article ๐Ÿ“… 1993 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 774 KB

Molecular orbital calculations reveal that the keto tautomer of HOCHCHNHNCHz, unlike the enol, does not represent a minimum in the ground state proton transfer potential. Excitation to the first excited singlet or triplet state leads to a rapid and barrierless transfer to the keto which becomes stro