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Author(s):   Dharmarathne, N.K.; Mackie, J.C.; Kennedy, E.M.; Stockenhuber, M.
Title:   Mechanism and Rate of Thermal Decomposition of Hexachlorocyclopentadiene and Its Importance in PCDD/F Formation from the Combustion of Cyclodiene Pesticides
Journal:   J. Phys. Chem. A
Volume:   121
Page(s):   5871 - 5883
Year:   2017
Reference type:   Journal article
Squib:   2017DHA/MAC5871-5883

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
  2017DHA/MAC5871-5883   Hexachlorocyclopentadiene → Pentachlorocyclopentadienyl + ·Cl  500 - 2000   1.45E15       2.22E05      1
  2017DHA/MAC5871-5883   Nonachloro-[dicyclopentadienyl]-1-yl → C10Cl9  690 - 923   2.90E11       8.62E04      1
  2017DHA/MAC5871-5883   C10Cl9Octachloronaphthalene + ·Cl  690 - 923   3.10E13       9.62E04      1
  2017DHA/MAC5871-5883   C10Cl9 → Nonachloro-[dicyclopentadienyl]-1-yl  690 - 923   1.80E13       2.60E04      1
  2017DHA/MAC5871-5883   Pentachlorocyclopentadienyl + ·ClHexachlorocyclopentadiene  690 - 923   6.11E-12       -1.64E04      2
  2017DHA/MAC5871-5883   Decachlorodicyclopentadienyl → Nonachloro-[dicyclopentadienyl]-1-yl + ·Cl  690 - 923   1.54E18   -15.00   1.03E05      1
  2017DHA/MAC5871-5883   Pentachlorocyclopentadienoxy → CCl2=CClCCl=CCl· + CO  690 - 923   5.00E13       1.26E05      1
  2017DHA/MAC5871-5883   CCl2=CClCCl=CCl· → ClC≡CCl + CCl2=CCl  690 - 923   5.00E15       2.10E05      1
  2017DHA/MAC5871-5883   CCl2=CCl → ClC≡CCl + ·Cl  690 - 923   1.00E14       1.34E05      1
  2017DHA/MAC5871-5883   Decachlorodicyclopentadienyl + O2 → Pentachlorocyclopentadienoxy + Pentachlorocyclopentadienoxy  690 - 923   1.16E-11   6.00   1.09E05      2
  2017DHA/MAC5871-5883   CCl2=CClCCl=CCl· + ClC≡CClHexachlorobenzene + ·Cl  690 - 923   8.30E-10       4600      2
  2017DHA/MAC5871-5883   Pentachlorocyclopentadienyl + → Pentachlorocyclopentadienoxy  690 - 923   9.96E-11              2
  2017DHA/MAC5871-5883   O2 + CCl2=CCl → COCl2 + CO + ·Cl  690 - 923   1.16E-10       1.05E05      2
  2017DHA/MAC5871-5883   Hexachlorocyclopentadiene + ·Cl → Pentachlorocyclopentadienyl + Cl2  690 - 923   1.17E-10   -1.85   6.59E04      2
  2017DHA/MAC5871-5883   Pentachlorocyclopentadienyl + Pentachlorocyclopentadienyl → Nonachloro-[dicyclopentadienyl]-1-yl + ·Cl  690 - 923   8.30E-11       5900      2
  2017DHA/MAC5871-5883   Nonachloro-[dicyclopentadienyl]-1-yl + ·ClDecachlorodicyclopentadienyl  690 - 923   1.16E-10              2
  2017DHA/MAC5871-5883   ClC≡CCl + CCl2=CCl → CCl2=CClCCl=CCl·  690 - 923   1.69E-11       1.93E04      2
  2017DHA/MAC5871-5883   ClC≡CCl + ·Cl → CCl2=CCl  690 - 923   2.71E-11       -2.75E04      2
  2017DHA/MAC5871-5883   Pentachlorocyclopentadienyl + Cl2Hexachlorocyclopentadiene + ·Cl  690 - 923   5.98E-14       5.75E04      2

Search returned 19 records.