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Accessibility information
Author(s):   Irle, S.; Morokuma, K.
Title:   A molecular orbital study on H and H2 elimination pathways from methane, ethane, and propane
Journal:   J. Chem. Phys.
Volume:   113
Page(s):   6139 - 6148
Year:   2000
Reference type:   Journal article
Squib:   2000IRL/MOR6139-6148

Reaction:   C3H8H2 + ·CH2CH2CH2·
Reaction order:   1
Temperature:   3392 K
Rate expression:   3.82x105 [s-1]
Category:  Theory
Data type:   Ab initio

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