PM7 Accuracy

trifluorochloromethane   2428 Trifluorochloromethane

(Previous)     (Back)     (Next)         Geometry predicted using PM7

   

    #  Species Formula
  2418 ClO3F (Geo)O3FCl
  2419 Perchloryl fluorideO3FCl
  2420 ClF2F2Cl
  2421 BClF2 (Geo)BF2Cl
  2422 ChlorodifluorboraneBF2Cl
  2423 Chlorodifluoromethane (Geo)HCF2Cl
  2424 DifluorochloromethaneHCF2Cl
  2425 NClF2NF2Cl
  2426 Chlorine trifluorideF3Cl
  2427 Chlorine trifluoride (Geo)F3Cl
  2428 Trifluorochloromethane CF3Cl
  2429 ChlorotrifluoroetheneC2F3Cl
  2430 Chlorine pentafluorideF5Cl
  2431 Chlorine pentafluoride (Geo)F5Cl
  2432 ChloropentafluoroethaneC2F5Cl
  2433 ChloropentafluorobenzeneC6F5Cl
  2434 1,1,2-Trifluoro-2-chloroethyl dodecafluoroheptyletherC9H4OF15Cl
  2435 1,1,2-Trifluoro-2-chloroethyl perfluoroheptyletherC9H4OF15Cl
  2436 Neon chloride anion (Geo)NeCl
  2437 Sodium chloride, cationNaCl
  2438 Sodium chloride (Geo)NaCl


DHf: -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