Accuracy
trifluorochloromethane
1727 Trifluorochloromethane
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Geometry predicted using PM7
ΔHf: -169.2 kcal/mol, REF: M. W. Chase, C. A. Davies, J. R. Downey, D. R. Frurip, R. A. McDonald, A. N. Syverud, JANAF Thermochemical Tables, Third Edition, J. Phys. Chem. Ref. Data 14, Suppl. 1 (1985).
I.P.: 10.3 eV, REF: R. D. Levin, S. G. Lias, "Ionization Potentials and Appearance Potential Measurements," 1971-1981, Natl. Stand. Ref. Data Ser., Natl. Bur. Stand. 71, (1982), Cat. No. C13.48:71.
Trifluorochloromethane
HR=JANAF86 H=-169.2 I=10.3 IR=LLNBS82
Cl 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.75123784 +1 0.0000000 +0 0.0000000 +0 1 0 0
F 1.32213758 +1 111.3672960 +1 0.0000000 +0 2 1 0
F 1.32213126 +1 111.3630977 +1 120.0211985 +1 2 1 3
F 1.32221375 +1 111.3357889 +1 -119.9787115 +1 2 1 3