PM7 Accuracy

fluorotrichloromethane   2579 Fluorotrichloromethane

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    #  Species Formula
  2569 1,2,2-TrichloroethaneC2H3Cl3
  2570 1,2,3-TrichlorobenzeneC6H3Cl3
  2571 1,2,4-TrichlorobenzeneC6H3Cl3
  2572 1,3,5-TrichlorobenzeneC6H3Cl3
  2573 Be(II)Cl3N(-) (FASQUM) (Geo)H7BeC2NCl3
  2574 Be(II)Cl3N(-) (FASQUM)H7BeC2NCl3
  2575 B3N3Cl3H3H3B3N3Cl3
  2576 TrichloroacetaldehydeHC2OCl3
  2577 B3O3Cl3B3O3Cl3
  2578 Trichlorofluoromethane (Geo)CFCl3
  2579 Fluorotrichloromethane CFCl3
  2580 1,1',2-Trichloro-1,2,2'-trifluoroethaneC2F3Cl3
  2581 Aluminum trichloride (Geo)AlCl3
  2582 Aluminum trichlorideAlCl3
  2583 Al(III)Cl3N (CMAMAL01) (Geo)C3H9NAlCl3
  2584 Al(III)Cl3N (CMAMAL01)C3H9NAlCl3
  2585 Trimethyamine-Aluminum trichloride (Geo)C3H9NAlCl3
  2586 TrichlorosilylSiCl3
  2587 TrichlorosilaneHSiCl3
  2588 Trichloromethylsilane (Geo)CH3SiCl3
  2589 TrichloromethylsilaneCH3SiCl3


DHf: -69.0 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.: 11.9 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.
  
 SYMMETRY PM7
Fluorotrichloromethane
 H=-69 HR=JANAF86 I=11.9 IR=LLNBS82
  F     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.32760114  1    0.0000000  0    0.0000000  0     1     0     0
 Cl     1.75501638  1  108.0818545  1    0.0000000  0     2     1     0
 Cl     1.75501638  1  108.0818545  1  120.0000000  1     2     1     3
 Cl     1.75501638  1  108.0818545  1 -120.0000000  1     2     1     3
 
   3  1    4    5
   3  2    4    5