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Author(s):   Bacskay, G.B.; Mackie, J.C.
Title:   The Pyrolysis of Cyclopentadiene: Quantum Chemical and Kinetic Modelling Studies of the Acetylene Plus Propyne/Allene Decomposition Channels
Journal:   Phys. Chem. Chem. Phys.
Volume:   3
Page(s):   2467 - 2473
Year:   2001
Reference type:   Journal article
Squib:   2001BAC/MAC2467-2473

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
  2001BAC/MAC2467-2473   CyclopentadieneCyclopentadienyl +   1476 - 1618   2.50E15       3.43E05      1
  2001BAC/MAC2467-2473   CyclopentadieneCH2=C=CHCH=CH2  1476 - 1618   1.35E15       3.37E05      1
  2001BAC/MAC2467-2473   CH2=C=CHCH=CH2C2H2 + CH3CCH  1476 - 1618   2.88E13       2.78E05      1
  2001BAC/MAC2467-2473   CyclopentadieneC2H2 + CH2=C=CH2  1476 - 1618   3.80E17       4.35E05      1
  2001BAC/MAC2467-2473   CyclopentadieneCH2=CHCH2C≡CH  1476 - 1618   8.50E14       3.79E05      1
  2001BAC/MAC2467-2473   CH2=CHCH2C≡CHC2H2 + CH2=C=CH2  1476 - 1618   3.55E13       2.65E05      1
  2001BAC/MAC2467-2473   Cyclopentadienyl → 1,3-cyclopentadien-2-yl  1476 - 1618   7.08E13       2.74E05      1
  2001BAC/MAC2467-2473   1,3-cyclopentadien-2-yl → HC≡CCH=CHCH2·  1476 - 1618   1.45E14       2.13E05      1

Search returned 8 records.