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Decomposition of S -Nitrosothiols: Unimolecular versus Autocatalytic Mechanism

โœ Scribed by Grossi, Loris; Montevecchi, Pier Carlo; Strazzari, Samantha


Book ID
121422911
Publisher
American Chemical Society
Year
2001
Tongue
English
Weight
36 KB
Volume
123
Category
Article
ISSN
0002-7863

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## Abstract The decomposition pathways of chloromethanol have been studied by __ab initio__ calculation. Equilibriums and transition states have been optimized at the UMP2(full)/6โ€“31G(d) level. The single point energies have been obtained at higher level of G3 (MP2). Four transition states and eigh