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Author(s):   Brana, P.; Menendez, B.; Fernandez, T.; Sordo, J.A.
Title:   The Role of Bridged Structures in the Mechanism of the Reaction Between Chlorine Atom and Ethylene
Journal:   Chem. Phys. Lett.
Volume:   325
Page(s):   693 - 697
Year:   2000
Reference type:   Journal article
Squib:   2000BRA/MEN693-697

Reaction:   C2H4 + ·Cl → CH2CH2Cl
Reaction order:   2
Rate expression:   no rate data available
Category:  Theory
Data type:   Mechanistic information only
Comments:   Ab inition study of the potential energy surface associated with the addition of Cl to C2H4 at the MP2/6-31G(d,p) level of theory. Provides new information on the role played by bridged structures in the mechanism.

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