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Chemical Sciences Division
Applied Chemicals and Materials Division
Tahan, A.; Shiroudi, A.
Oxidation reaction mechanism and kinetics between OH radicals and alkyl-substituted aliphatic thiols: OH-addition pathways
Prog. React. Kinet. Mech.
157 - 174
C2H5SH + ·OH → H2O + CH3CH2S
252 - 425
Pressure: 1.00E-8 - 1.00E8 bar
no rate data available
Transition state theory
Rate constant is pressure dependent
Reaction potential energy surface was studied using quantum chemistry and reaction channels were analyzed. Rate constants were calculated over ranges of temperatures and pressures using transition state theory and RRKM. No Arrhenius expressions are given. Rate constants are presented in tabular and graphical formats.
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