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Title: Quantum scattering study of the abstraction reactions of H atoms from CH3NH2
Journal: Chem. Phys. Lett.
Volume: 438
Page(s): 1 - 7
Year: 2007
Reference type: Journal article
Squib: 2007KER/CLA1-7
Reaction:
CH3NH2 + H· → H2 + CH2NH2
Reaction order:
2
Temperature:
200 - 2000
K
Rate expression:
no rate data available
Category: Theory
Data type:
Other theoretical
Pressure dependence:
Rate constant is pressure independent
Comments:
Reaction potential energy surface was studied using quantum chemistry and rate constants were calculated using quantum scattering and transition state theory. 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 graphical format.
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