THE PYROLYSIS OF CCL4 AND C2CL6 IN THE GAS-PHASE - MECHANISTIC MODELING BY THERMODYNAMIC AND KINETIC PARAMETER-ESTIMATION

Authors
HUYBRECHTS G NARMON M VANMELE B
Citation
G. Huybrechts et al., THE PYROLYSIS OF CCL4 AND C2CL6 IN THE GAS-PHASE - MECHANISTIC MODELING BY THERMODYNAMIC AND KINETIC PARAMETER-ESTIMATION, International journal of chemical kinetics, 28(1), 1996, pp. 27-36
Citations number
31
Categorie Soggetti
Chemistry Physical
Journal title
International journal of chemical kinetics → ACNP
ISSN journal
05388066
Volume
28
Issue
1
Year of publication
1996
Pages
27 - 36
Database
ISI
SICI code
0538-8066(1996)28:1<27:TPOCAC>2.0.ZU;2-8
Abstract
A detailed radical reaction mechanism is proposed to describe the ther mal reactions of CCl4 and C2Cl6 in the gas phase quantitatively. A con sistent set of activation energies and preexponential factors For ail elementary reactions, in combination with enthalpies of formation and entropies for all species involved, is computer optimized to fit exper imental pressure-rise curves and concentration profiles. For this purp ose new experimental results on the pyrolysis of CCl4 are used, togeth er with published kinetic data on the pyrolysis of C2Cl6 (in the absen ce and in the presence of Cl-2). (C) 1996 John Wiley & Sons, Inc.