Issue 14, 1990

Reaction of CS2 with OH: a quantum chemical study

Abstract

Ab initio calculations on the reaction between carbon disulphide, CS2, and an OH radical predict that an intermediary complex is formed with OH attached to the carbon atom, the reaction being exothermic without an energy barrier, while unimolecular decomposition of this complex into OCS and SH by proton rearrangement is found to be hindered by a very high potential energy barrier.

Article information

Article type
Paper

J. Chem. Soc., Chem. Commun., 1990, 949-951

Reaction of CS2 with OH: a quantum chemical study

S. Lunell, M.-B. Huang, K. A. Sahetchian, C. Chachaty and F. Zabel, J. Chem. Soc., Chem. Commun., 1990, 949 DOI: 10.1039/C39900000949

To request permission to reproduce material from this article, please go to the Copyright Clearance Center request page.

If you are an author contributing to an RSC publication, you do not need to request permission provided correct acknowledgement is given.

If you are the author of this article, you do not need to request permission to reproduce figures and diagrams provided correct acknowledgement is given. If you want to reproduce the whole article in a third-party publication (excluding your thesis/dissertation for which permission is not required) please go to the Copyright Clearance Center request page.

Read more about how to correctly acknowledge RSC content.

Spotlight

Advertisements