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Rate constants for formation of bisulfite addition compounds: an examination in terms of No Barrier Theory

โœ Scribed by Guthrie, J. Peter; Wu, Yin-Yin; Bannister, Alexander R.; Peiris, Sriyawathie; Povar, Igor; Wilson, Elizabeth A.; Wang, Qiang


Book ID
127386555
Publisher
NRC Research Press
Year
2015
Tongue
French
Weight
220 KB
Volume
93
Category
Article
ISSN
0008-4042

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Uncatalyzed and Amine Catalyzed Decarbox
โœ J.Peter Guthrie ๐Ÿ“‚ Article ๐Ÿ“… 2002 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 101 KB

Rate constants for decarboxylation of acetoacetic acid, its anion, and its imine with aminoacetonitrile have been calculated from equilibrium constants and distortion energies using No Barrier Theory. The mechanisms of decarboxylation of both acetoacetic acid and its imine involve preequilibrium for