Title

Ab Initio Investigations of the Hydrolysis of the Carbamate Bond

Document Type

Article

Journal/Book Title

Journal of Molecular Structure: TheoChem

Publication Date

1-1990

Publisher

Elsevier

Volume

204

First Page

331

Last Page

335

DOI

10.1016/0166-1280(90)85084-Z

Abstract

The energies for model gas-phase decomposition and hydrolysis reactions ofcarbamic acid and methyl carbamate have been calculated at various levels of theory. The calculations indicate that esterification accelerates cleavage of the carbamate bond.

Comments

http://www.sciencedirect.com/science/article/pii/016612809085084Z

Publisher PDF is available for download through the link above.

Published by Elsevier in Journal of Molecular Structure.

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