Reappraisal ofciseffect in 1,2-dihaloethenes: An improved virtual orbital multireference approach

Chaudhuri, Rajat K. ; Hammond, Jeff R. ; Freed, Karl F. ; Chattopadhyay, Sudip ; Mahapatra, Uttam Sinha (2008) Reappraisal ofciseffect in 1,2-dihaloethenes: An improved virtual orbital multireference approach The Journal of Chemical Physics, 129 (6). 064101. ISSN 0021-9606

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Official URL: http://doi.org/10.1063/1.2958284

Related URL: http://dx.doi.org/10.1063/1.2958284

Abstract

Computed relative stabilities for isomers of 1,2-difluoroethene and 1,2-dichloroethene isomers are compared with predictions based on chemical hardness (

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