Atmospheric chemistry of CF3CH2CH2OH: kinetics, mechanisms and products of Cl atom and OH radical initiated oxidation in the presence and absence of NOX

Michael D. Hurley; Jessica A. Misner; James C. Ball; Timothy J. Wallington; D. A. Ellis; J. W. Martin; S. A. Mabury; Mads Peter Sulbæk Andersen

doi:10.1021/jp0535902

Atmospheric chemistry of CF₃CH₂CH₂OH: kinetics, mechanisms and products of Cl atom and OH radical initiated oxidation in the presence and absence of NO_X

Michael D. Hurley, Jessica A. Misner, James C. Ball, Timothy J. Wallington, D. A. Ellis, J. W. Martin, S. A. Mabury, Mads Peter Sulbæk Andersen

Kemisk Institut

41 Citationer (Scopus)

Abstract

Relative rate techniques were used to study the kinetics of the reactions of Cl atoms and OH radicals with CF3CH2C(O)H and CF3CH2CH2OH in 700 Torr of N-2 or air diluent at 296 2 K. The rate constants determined were k(Cl+CF3CH2C(O)H) = (1.81 +/- 0.27) x 10(-11), k(OH+CF3CH2C(O)H) = (2.57 +/- 0.44) x 10(-12), k(Cl+CF3CH2CH2OH) = (1.59 +/- 0.20) x 10(-11), and k(OH+CF3CH2CH2OH) = (6.91 +/- 0.91) x 10(-13) cm(3) molecule(-1) s(-1). Product studies of the chlorine initiated oxidation of CF3CH2CH2OH in the absence of NO show the sole primary product to be CF3CH2C(O)H. Product studies of the chlorine initiated oxidation of CF3CH2CH2OH in the presence of NO show the primary products to be CF3CH2C(O)H (81, HC(O)OH (10, and CF3C(O)H. Product studies of the chlorine initiated oxidation of CF3CH2C(O)H in the absence of NO show the primary products to be CF3C(O)H (76, CF3CH2C(O)OH (14, and CF3CH2C(O)OOH (

Originalsprog	Engelsk
Tidsskrift	Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory
Vol/bind	109
Udgave nummer	43
Sider (fra-til)	9816-9826
Antal sider	11
ISSN	1089-5639
DOI	https://doi.org/10.1021/jp0535902
Status	Udgivet - 2005

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10.1021/jp0535902

Citationsformater

Hurley, M. D., Misner, J. A., Ball, J. C., Wallington, T. J., Ellis, D. A., Martin, J. W., Mabury, S. A., & Andersen, M. P. S. (2005). Atmospheric chemistry of CF₃CH₂CH₂OH: kinetics, mechanisms and products of Cl atom and OH radical initiated oxidation in the presence and absence of NO_X. Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, 109(43), 9816-9826. https://doi.org/10.1021/jp0535902

Atmospheric chemistry of CF₃CH₂CH₂OH : kinetics, mechanisms and products of Cl atom and OH radical initiated oxidation in the presence and absence of NO_X. / Hurley, Michael D.; Misner, Jessica A.; Ball, James C. et al.

I: Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, Bind 109, Nr. 43, 2005, s. 9816-9826.

Publikation: Bidrag til tidsskrift › Tidsskriftartikel › Forskning › peer review

Hurley, MD, Misner, JA, Ball, JC, Wallington, TJ, Ellis, DA, Martin, JW, Mabury, SA & Andersen, MPS 2005, 'Atmospheric chemistry of CF₃CH₂CH₂OH: kinetics, mechanisms and products of Cl atom and OH radical initiated oxidation in the presence and absence of NO_X', Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory, bind 109, nr. 43, s. 9816-9826. https://doi.org/10.1021/jp0535902

Hurley MD, Misner JA, Ball JC, Wallington TJ, Ellis DA, Martin JW et al. Atmospheric chemistry of CF₃CH₂CH₂OH: kinetics, mechanisms and products of Cl atom and OH radical initiated oxidation in the presence and absence of NO_X. Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory. 2005;109(43):9816-9826. doi: 10.1021/jp0535902

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title = "Atmospheric chemistry of CF3CH2CH2OH: kinetics, mechanisms and products of Cl atom and OH radical initiated oxidation in the presence and absence of NOX",

abstract = "Relative rate techniques were used to study the kinetics of the reactions of Cl atoms and OH radicals with CF3CH2C(O)H and CF3CH2CH2OH in 700 Torr of N-2 or air diluent at 296 2 K. The rate constants determined were k(Cl+CF3CH2C(O)H) = (1.81 +/- 0.27) x 10(-11), k(OH+CF3CH2C(O)H) = (2.57 +/- 0.44) x 10(-12), k(Cl+CF3CH2CH2OH) = (1.59 +/- 0.20) x 10(-11), and k(OH+CF3CH2CH2OH) = (6.91 +/- 0.91) x 10(-13) cm(3) molecule(-1) s(-1). Product studies of the chlorine initiated oxidation of CF3CH2CH2OH in the absence of NO show the sole primary product to be CF3CH2C(O)H. Product studies of the chlorine initiated oxidation of CF3CH2CH2OH in the presence of NO show the primary products to be CF3CH2C(O)H (81, HC(O)OH (10, and CF3C(O)H. Product studies of the chlorine initiated oxidation of CF3CH2C(O)H in the absence of NO show the primary products to be CF3C(O)H (76, CF3CH2C(O)OH (14, and CF3CH2C(O)OOH (",

author = "Hurley, {Michael D.} and Misner, {Jessica A.} and Ball, {James C.} and Wallington, {Timothy J.} and Ellis, {D. A.} and Martin, {J. W.} and Mabury, {S. A.} and Andersen, {Mads Peter Sulb{\ae}k}",

year = "2005",

doi = "10.1021/jp0535902",

language = "English",

volume = "109",

pages = "9816--9826",

journal = "Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory",

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T1 - Atmospheric chemistry of CF3CH2CH2OH

T2 - kinetics, mechanisms and products of Cl atom and OH radical initiated oxidation in the presence and absence of NOX

AU - Hurley, Michael D.

AU - Misner, Jessica A.

AU - Ball, James C.

AU - Wallington, Timothy J.

AU - Ellis, D. A.

AU - Martin, J. W.

AU - Mabury, S. A.

AU - Andersen, Mads Peter Sulbæk

PY - 2005

Y1 - 2005

N2 - Relative rate techniques were used to study the kinetics of the reactions of Cl atoms and OH radicals with CF3CH2C(O)H and CF3CH2CH2OH in 700 Torr of N-2 or air diluent at 296 2 K. The rate constants determined were k(Cl+CF3CH2C(O)H) = (1.81 +/- 0.27) x 10(-11), k(OH+CF3CH2C(O)H) = (2.57 +/- 0.44) x 10(-12), k(Cl+CF3CH2CH2OH) = (1.59 +/- 0.20) x 10(-11), and k(OH+CF3CH2CH2OH) = (6.91 +/- 0.91) x 10(-13) cm(3) molecule(-1) s(-1). Product studies of the chlorine initiated oxidation of CF3CH2CH2OH in the absence of NO show the sole primary product to be CF3CH2C(O)H. Product studies of the chlorine initiated oxidation of CF3CH2CH2OH in the presence of NO show the primary products to be CF3CH2C(O)H (81, HC(O)OH (10, and CF3C(O)H. Product studies of the chlorine initiated oxidation of CF3CH2C(O)H in the absence of NO show the primary products to be CF3C(O)H (76, CF3CH2C(O)OH (14, and CF3CH2C(O)OOH (

AB - Relative rate techniques were used to study the kinetics of the reactions of Cl atoms and OH radicals with CF3CH2C(O)H and CF3CH2CH2OH in 700 Torr of N-2 or air diluent at 296 2 K. The rate constants determined were k(Cl+CF3CH2C(O)H) = (1.81 +/- 0.27) x 10(-11), k(OH+CF3CH2C(O)H) = (2.57 +/- 0.44) x 10(-12), k(Cl+CF3CH2CH2OH) = (1.59 +/- 0.20) x 10(-11), and k(OH+CF3CH2CH2OH) = (6.91 +/- 0.91) x 10(-13) cm(3) molecule(-1) s(-1). Product studies of the chlorine initiated oxidation of CF3CH2CH2OH in the absence of NO show the sole primary product to be CF3CH2C(O)H. Product studies of the chlorine initiated oxidation of CF3CH2CH2OH in the presence of NO show the primary products to be CF3CH2C(O)H (81, HC(O)OH (10, and CF3C(O)H. Product studies of the chlorine initiated oxidation of CF3CH2C(O)H in the absence of NO show the primary products to be CF3C(O)H (76, CF3CH2C(O)OH (14, and CF3CH2C(O)OOH (

U2 - 10.1021/jp0535902

DO - 10.1021/jp0535902

M3 - Journal article

C2 - 16833295

SN - 1089-5639

VL - 109

SP - 9816

EP - 9826

JO - Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory

JF - Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory

IS - 43

ER -

Atmospheric chemistry of CF3CH2CH2OH: kinetics, mechanisms and products of Cl atom and OH radical initiated oxidation in the presence and absence of NOX

Abstract

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Citationsformater

Atmospheric chemistry of CF₃CH₂CH₂OH: kinetics, mechanisms and products of Cl atom and OH radical initiated oxidation in the presence and absence of NO_X