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Theoretical Study of the Mechanisms for the Alkoxyacetic Acids Decomposition

✍ Scribed by Domingo, Luis R.; Picher, María T.; Safont, Vicent S.; Andrés, Juan; Chuchani, Gabriel

Book ID
120492905
Publisher
American Chemical Society
Year
1999
Tongue
English
Weight
178 KB
Volume
103
Category
Article
ISSN
1089-5639

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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)/6–31G(d) level. The single point energies have been obtained at higher level of G3 (MP2). Four transition states and eigh