Rate Coefficients of the Cl + CH3C(O)OCH3→ HCl + CH3C(O)OCH2 Reaction at Different Temperatures Calculated by Transition-State Theory with ab Initio and Density Functional Theory Reaction Paths

Ronald Chow; Maggie Ng; Daniel K. W. Mok; Edmond P. F. Lee; John M. Dyke

doi:10.1021/jp5000864

Rate Coefficients of the Cl + CH3C(O)OCH3→ HCl + CH3C(O)OCH2 Reaction at Different Temperatures Calculated by Transition-State Theory with ab Initio and Density Functional Theory Reaction Paths

Ronald Chow
, Maggie Ng
, Daniel K. W. Mok
, Edmond P. F. Lee
, John M. Dyke

Department of Chemistry

Research output: Contribution to journal › Article › peer-review

17 Citations (Scopus)

Original language	English
Pages (from-to)	2040-2055
Journal	Journal of Physical Chemistry A
Volume	118
Issue number	11
DOIs	https://doi.org/10.1021/jp5000864
Publication status	Published - 2014

Access to Document

10.1021/jp5000864

Cite this

Rate Coefficients of the Cl + CH3C(O)OCH3→ HCl + CH3C(O)OCH2 Reaction at Different Temperatures Calculated by Transition-State Theory with ab Initio and Density Functional Theory Reaction Paths. / Chow, Ronald; Ng, Maggie; Mok, Daniel K. W. et al.
In: Journal of Physical Chemistry A, Vol. 118, No. 11, 2014, p. 2040-2055.

Research output: Contribution to journal › Article › peer-review

@article{ccc12a0fa1fb4c07bacd6f4f7ee758c7,

title = "Rate Coefficients of the Cl + CH3C(O)OCH3→ HCl + CH3C(O)OCH2 Reaction at Different Temperatures Calculated by Transition-State Theory with ab Initio and Density Functional Theory Reaction Paths",

author = "Ronald Chow and Maggie Ng and Mok, \{Daniel K. W.\} and Lee, \{Edmond P. F.\} and Dyke, \{John M.\}",

year = "2014",

doi = "10.1021/jp5000864",

language = "English",

volume = "118",

pages = "2040--2055",

journal = "Journal of Physical Chemistry A",

issn = "1089-5639",

publisher = "American Chemical Society",

number = "11",

}

TY - JOUR

T1 - Rate Coefficients of the Cl + CH3C(O)OCH3→ HCl + CH3C(O)OCH2 Reaction at Different Temperatures Calculated by Transition-State Theory with ab Initio and Density Functional Theory Reaction Paths

AU - Chow, Ronald

AU - Ng, Maggie

AU - Mok, Daniel K. W.

AU - Lee, Edmond P. F.

AU - Dyke, John M.

PY - 2014

Y1 - 2014

U2 - 10.1021/jp5000864

DO - 10.1021/jp5000864

M3 - Article

AN - SCOPUS:84897861456

SN - 1089-5639

VL - 118

SP - 2040

EP - 2055

JO - Journal of Physical Chemistry A

JF - Journal of Physical Chemistry A

IS - 11

ER -