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Accessibility information
Author(s):   Wang, B.; Hou, H.; Gu. Y.
Title:   Ab Initio/Density Functional Theory and Multichannel RRKM Calculations for the CH3O + CO Reaction
Journal:   J. Phys. Chem. A
Volume:   103
Page(s):   8021 - 8029
Year:   1999
Reference type:   Journal article
Squib:   1999WAN/HOU8021-8029

Associated entries:

Search Results


Rate expression:  k(T) = A (T/298 K)n e-Ea/RT
Rate expression units:
First order:  s-1
Second order:  cm3/molecule s
Third order:  cm6/molecule2 s
R = 8.314472 J / mole K
Energy Units J   Molecular Units Molecule
Pressure Units bar   Temperature Units K
Base Volume Unit cm   Reference Temperature 298.0
Evaluation Temperature 298.0

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| |
Plot   Squib   Reaction   Temp [K]   A   n   Ea [J/mole]   k(298.00 K)   Order
  1999WAN/HOU8021-8029   CO + CH3 → Products  200 - 1000   1.00E-10   -4.93   3.80E04   2.20E-17  2
  1999WAN/HOU8021-8029   CO + CH3 → Products  1000 - 1500   8.45E-47   32.17   -2.78E05      2
  1999WAN/HOU8021-8029   CO + CH3 → Products  1500 - 3500   3.23E-13   2.28   8.41E04      2
  1999WAN/HOU8021-8029   CO + CH3CO2 + ·CH3  250   3.16E-28              2
  1999WAN/HOU8021-8029   CO + CH3 → ·CH2C(O)OH  250   3.11E-37              2
  1999WAN/HOU8021-8029   CO + CH3CH2O + HCO  250   1.03E-35              2
  1999WAN/HOU8021-8029   CO + CH3 → CH3OCO  250   1.39E-19              2
  1999WAN/HOU8021-8029   CO + CH3 → CH3C(O)O  250   1.60E-38              2
  1999WAN/HOU8021-8029   CO + CH3 → HC(O)OCH2(·)  250   5.74E-37              2
  1999WAN/HOU8021-8029   CO + CH3CH2O + HCO  250   3.26E-33              2
  1999WAN/HOU8021-8029   CO + CH3CO2 + ·CH3  2500   1.32E-13              2
  1999WAN/HOU8021-8029   CO + CH3 → ·CH2C(O)OH  2500   5.12E-16              2
  1999WAN/HOU8021-8029   CO + CH3CH2O + HCO  2500   5.23E-15              2
  1999WAN/HOU8021-8029   CO + CH3 → CH3OCO  2500   3.10E-17              2
  1999WAN/HOU8021-8029   CO + CH3 → CH3C(O)O  2500   3.74E-19              2
  1999WAN/HOU8021-8029   CO + CH3 → HC(O)OCH2(·)  2500   1.61E-19              2
  1999WAN/HOU8021-8029   CO + CH3CH2O + HCO  2500   5.90E-13              2

Search returned 17 records.