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Formyl chloride


Gas phase ion energetics data

Go To: Top, Vibrational and/or electronic energy levels, NIST Free Links, References, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi

Ionization energy determinations

IE (eV) Method Reference
11.51PEFrost, McDowell, et al., 1977

Vibrational and/or electronic energy levels

Go To: Top, Gas phase ion energetics data, NIST Free Links, References, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: Marilyn E. Jacox

State:   A


 Energy 
 (cm-1
 Med.   Transition   «lambda»min 
 (nm) 
 «lambda»max 
 (nm) 
 References

To = 32760 gas A-X 230 314 Judge and Moule, 1985
Libuda, Zabel, et al., 1990
Ding, Orr-Ewing, et al., 1999


Vib. 
sym. 
 No.   Approximate 
 type of mode 
 cm-1   Med.   Method   References

a' 2 CO stretch 1153.8 gas AB Judge and Moule, 1985
4 CCl stretch 633.6 gas AB Judge and Moule, 1985
5 ClCO deform. 306.3 gas AB Judge and Moule, 1985
a 6 Umbrella (OPLA) 779.5 gas AB Judge and Moule, 1985

State:   X


Vib. 
sym. 
 No.   Approximate 
 type of mode 
 cm-1   Med.   Method   References

a' 1 CH stretch 2929.18 w gas IR Hisatsune and Heicklen, 1973
Niki, Maker, et al., 1978
Libuda, Zabel, et al., 1990
2 CO stretch 1784.14 vs gas IR Hisatsune and Heicklen, 1973
Niki, Maker, et al., 1978
Libuda, Zabel, et al., 1990
Joo, Clouthier, et al., 1994
3 CH bend 1307.21 m gas IR Hisatsune and Heicklen, 1973
Niki, Maker, et al., 1978
Libuda, Zabel, et al., 1990
Joo, Clouthier, et al., 1993
4 CCl stretch 738.80 vs gas IR Hisatsune and Heicklen, 1973
Niki, Maker, et al., 1978
Libuda, Zabel, et al., 1990
French, Clouthier, et al., 1994
5 CCl bend 457.02 w gas IR Hisatsune and Heicklen, 1973
Libuda, Zabel, et al., 1990
French, Clouthier, et al., 1994
a 6 OPLA 932.15 w gas IR Hisatsune and Heicklen, 1973
Niki, Maker, et al., 1978
Libuda, Zabel, et al., 1990
Joo, Clouthier, et al., 1995

Additional references: Jacox, 1994, page 170; Jacox, 1998, page 239; Jacox, 2003, page 194; Takeo and Matsumura, 1976; Davis and Gerry, 1983; Joo, Laboy, et al., 1995

Notes

wWeak
mMedium
vsVery strong
oEnergy separation between the v = 0 levels of the excited and electronic ground states.

References

Go To: Top, Gas phase ion energetics data, Vibrational and/or electronic energy levels, NIST Free Links, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Frost, McDowell, et al., 1977
Frost, D.C.; McDowell, C.A.; Westwood, N.P.C., The photoelectron spectrum of formyl chloride, Chem. Phys. Lett., 1977, 51, 607. [all data]

Judge and Moule, 1985
Judge, R.H.; Moule, D.C., The electronic transition in formyl chloride, CHClO, J. Mol. Spectrosc., 1985, 113, 2, 302, https://doi.org/10.1016/0022-2852(85)90269-3 . [all data]

Libuda, Zabel, et al., 1990
Libuda, H.G.; Zabel, F.; Fink, E.H.; Becker, K.H., Formyl chloride: UV absorption cross sections and rate constants for the reactions with chlorine atom and hydroxyl radical, J. Phys. Chem., 1990, 94, 15, 5860, https://doi.org/10.1021/j100378a047 . [all data]

Ding, Orr-Ewing, et al., 1999
Ding, H.; Orr-Ewing, A.J.; Dixon, R.N., Rotational structure in the Ã1A´´--X1A´ spectrum of formyl chloride, Phys. Chem. Chem. Phys., 1999, 1, 18, 4181, https://doi.org/10.1039/a904907j . [all data]

Hisatsune and Heicklen, 1973
Hisatsune, I.C.; Heicklen, J., Can. J. Spectrosc., 1973, 18, 77. [all data]

Niki, Maker, et al., 1978
Niki, H.; Maker, P.D.; Breitenbach, L.P.; Savage, C.M., FTIR studies of the kinetics and mechanism for the reaction of Cl atom with formaldehyde, Chem. Phys. Lett., 1978, 57, 4, 596, https://doi.org/10.1016/0009-2614(78)85328-7 . [all data]

Joo, Clouthier, et al., 1994
Joo, D.L.; Clouthier, D.J.; Merer, A.J., Determination of the spectroscopic constants of a dark vibrational state: Fermi and Coriolis perturbations in the «nu»2 band of formyl chloride, J. Chem. Phys., 1994, 101, 1, 31, https://doi.org/10.1063/1.468191 . [all data]

Joo, Clouthier, et al., 1993
Joo, D.L.; Clouthier, D.J.; Lau, B.; Merer, A.J., An Analysis of the High-Resolution Infrared Spectrum of the «nu»3 Band of Formyl Chloride, J. Mol. Spectrosc., 1993, 161, 1, 123, https://doi.org/10.1006/jmsp.1993.1221 . [all data]

French, Clouthier, et al., 1994
French, J.L.; Clouthier, D.J.; Chan, C.P.; Ma, E.S.F.; Lai, V.W.-M.; Merer, A.J.; Judge, R.H., Rotational Analysis of the High-Resolution Infrared Spectra of the «nu»4 and «nu»5 Bands of Formyl Chloride, J. Mol. Spectrosc., 1994, 168, 1, 99, https://doi.org/10.1006/jmsp.1994.1263 . [all data]

Joo, Clouthier, et al., 1995
Joo, D.-L.; Clouthier, D.J.; Merer, A.J., A High-Resolution Fourier Transform Infrared Study of the Out-of-Plane Bending Fundamentals of HCOCl and DCOCl, J. Mol. Spectrosc., 1995, 174, 2, 353, https://doi.org/10.1006/jmsp.1995.0007 . [all data]

Jacox, 1994
Jacox, M.E., Vibrational and electronic energy levels of polyatomic transient molecules, American Chemical Society, Washington, DC, 1994, 464. [all data]

Jacox, 1998
Jacox, M.E., Vibrational and electronic energy levels of polyatomic transient molecules: supplement A, J. Phys. Chem. Ref. Data, 1998, 27, 2, 115-393, https://doi.org/10.1063/1.556017 . [all data]

Jacox, 2003
Jacox, M.E., Vibrational and electronic energy levels of polyatomic transient molecules: supplement B, J. Phys. Chem. Ref. Data, 2003, 32, 1, 1-441, https://doi.org/10.1063/1.1497629 . [all data]

Takeo and Matsumura, 1976
Takeo, H.; Matsumura, C., Microwave spectrum of formyl chloride, J. Chem. Phys., 1976, 64, 11, 4536, https://doi.org/10.1063/1.432083 . [all data]

Davis and Gerry, 1983
Davis, R.W.; Gerry, M.C.L., The microwave spectrum, harmonic force field, and structure of formyl chloride, J. Mol. Spectrosc., 1983, 97, 1, 117, https://doi.org/10.1016/0022-2852(83)90340-5 . [all data]

Joo, Laboy, et al., 1995
Joo, D.-L.; Laboy, J.; Kolomeisky, A.; Zhuo, Q.; Clouthier, D.J.; Chan, C.P.; Merer, A.J.; Judge, R.H., A High-Resolution Fourier Transform Infrared Study of the «nu»3, «nu»4, and «nu»5 Bands of Deuterated Formyl Chloride (DCOCl), J. Mol. Spectrosc., 1995, 170, 2, 346, https://doi.org/10.1006/jmsp.1995.1076 . [all data]


Notes

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