PM7 Accuracy Date:Mon Feb 11 04:20:05 2019

trifluorochloromethane   2426 Trifluorochloromethane

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    #  Species Formula
  2416 ClO3F (Geo)O3FCl
  2417 Perchloryl fluorideO3FCl
  2418 ClF2F2Cl
  2419 BClF2 (Geo)BF2Cl
  2420 ChlorodifluorboraneBF2Cl
  2421 Chlorodifluoromethane (Geo)HCF2Cl
  2422 DifluorochloromethaneHCF2Cl
  2423 NClF2NF2Cl
  2424 Chlorine trifluorideF3Cl
  2425 Chlorine trifluoride (Geo)F3Cl
  2426 Trifluorochloromethane CF3Cl
  2427 ChlorotrifluoroetheneC2F3Cl
  2428 Chlorine pentafluorideF5Cl
  2429 Chlorine pentafluoride (Geo)F5Cl
  2430 ChloropentafluoroethaneC2F5Cl
  2431 ChloropentafluorobenzeneC6F5Cl
  2432 1,1,2-Trifluoro-2-chloroethyl dodecafluoroheptyletherC9H4OF15Cl
  2433 1,1,2-Trifluoro-2-chloroethyl perfluoroheptyletherC9H4OF15Cl
  2434 Neon chloride anion (Geo)NeCl
  2435 Sodium chloride, cationNaCl
  2436 Sodium chloride (Geo)NaCl


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.
  
 PM7
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