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Competing S(N)2 and E2 reaction pathways for hexachlorocyclohexane degradation in the gas phase, solution and enzymes.

Authors :
Brittain DR
Pandey R
Kumari K
Sharma P
Pandey G
Lal R
Coote ML
Oakeshott JG
Jackson CJ
Source :
Chemical communications (Cambridge, England) [Chem Commun (Camb)] 2011 Jan 21; Vol. 47 (3), pp. 976-8. Date of Electronic Publication: 2010 Nov 16.
Publication Year :
2011

Abstract

Quantum chemistry calculations have been used alongside experimental kinetic analysis to investigate the competition between S(N)2 and E2 mechanisms for the dechlorination of hexachlorocyclohexane isomers, revealing that enzyme specificity reflects the intrinsic reactivity of the various isomers.

Details

Language :
English
ISSN :
1364-548X
Volume :
47
Issue :
3
Database :
MEDLINE
Journal :
Chemical communications (Cambridge, England)
Publication Type :
Academic Journal
Accession number :
21082075
Full Text :
https://doi.org/10.1039/c0cc02925d