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Methane, chlorofluoro-

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Gas phase ion energetics data

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

Data compiled as indicated in comments:
B - John E. Bartmess
LBLHLM - Sharon G. Lias, John E. Bartmess, Joel F. Liebman, John L. Holmes, Rhoda D. Levin, and W. Gary Mallard
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi

Ionization energy determinations

IE (eV) Method Reference Comment
11.74PEDoucet, Sauvageau, et al., 1973LLK
11.71 ± 0.01PEAndrews, Dyke, et al., 1984Vertical value; LBLHLM

De-protonation reactions

CHClF- + Hydrogen cation = Methane, chlorofluoro-

By formula: CHClF- + H+ = CH2ClF

Quantity Value Units Method Reference Comment
Deltar385.94 ± 0.95kcal/molG+TSPoutsma, Paulino, et al., 1997gas phase; Relative to MeOH at «DELTA»Gacid=375.1; B
Quantity Value Units Method Reference Comment
Deltar376.70 ± 0.30kcal/molIMREPoutsma, Paulino, et al., 1997gas phase; Relative to MeOH at «DELTA»Gacid=375.1; B

References

Go To: Top, Gas phase ion energetics data, Notes

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

Doucet, Sauvageau, et al., 1973
Doucet, J.; Sauvageau, P.; Sandorfy, C., Vacuum ultraviolet and photoelectron spectra of fluoro-chloro derivatives of methane, J. Chem. Phys., 1973, 58, 3708. [all data]

Andrews, Dyke, et al., 1984
Andrews, L.; Dyke, J.M.; Jonathan, N.; Keddar, N.; Morris, A., Photoelectron spectroscopic study of the ground states of CH2Cl+, CHCl2+, and CHFCl+, J. Am. Chem. Soc., 1984, 106, 299. [all data]

Poutsma, Paulino, et al., 1997
Poutsma, J.C.; Paulino, J.A.; Squires, R.R., Absolute Heats of Formation of CHCl, CHF, and CClF. A Gas-Phase Experimental and G2 Theoretical Study., J. Phys. Chem. A, 1997, 101, 29, 5327, https://doi.org/10.1021/jp970778f . [all data]


Notes

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