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Title: Relative reactivity and regioselectivity of halogen-substituted ethenes and propene toward addition of an OH radical or O (3P) atom: An ab initio study
Journal: J. Mol. Struct. Theochem
Volume: 770
Page(s): 59 - 65
Year: 2006
Reference type: Journal article
Squib: 2006ELN/UCH59-65
Reaction:
CH2=CCl2 + O· → ·CH2CCl2O·
Reaction order:
2
Rate expression:
no rate data available
Category: Theory
Data type:
Ab initio
Comments:
Reaction potential energy surface was studied using quantum chemistry and product channels were analyzed. No rate constant values were calculated.
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