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Author(s):   Tian, W.; Wang, W.L.; Zhang, Y.; Wang, W.N.
Title:   Direct Dynamics Study on the Mechanism and the Kinetics of the Reaction of CH3NH2 With OH
Journal:   Int. J. Quant. Chem.
Volume:   109
Page(s):   1566 - 1575
Year:   2009
Reference type:   Journal article
Squib:   2009TIA/WAN1566-1575

Reaction:   CH3NH2 + ·OH → Products
Reaction order:   2
Temperature:   299 - 3000 K
Rate expression:   no rate data available
Category:  Theory
Data type:   Transition state theory
Pressure dependence:   Rate constant is pressure independent
Comments:   Reaction potential energy surface was studied using quantum chemistry and rate constants were calculated using transition state theory with tunneling correction. Rate constants were calculated for a wide range of temperatures; however, no Arrhenius expression is given for the k(T) dependence. Instead, rate constants for individual temperatures are presented in a tabular format.

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