Accuracy

cf3ch2.   1588 CF3CH2.

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

    

    #  Species Formula
  1578 Boron trifluorideBF3
  1579 Trifluoromethyl, cationCF3
  1580 TrifluoromethylCF3
  1581 Trifluoromethyl, anionCF3
  1582 Trifluoromethane, cationHCF3
  1583 Trifluoromethane (Geo)HCF3
  1584 TrifluoromethaneHCF3
  1585 TrifluoroethyleneHC2F3
  1586 CF3CH2, cationC2H2F3
  1587 CH2F.CF2, cationC2H2F3
  1588 CF3CH2. C2H2F3
  1589 1,1,1-TrifluoroethaneC2H3F3
  1590 (Trifluoromethyl)-benzeneC7H5F3
  1591 TrifluoromethylbenzeneC7H5F3
  1592 Nitrogen trifluoride (Geo)NF3
  1593 Nitrogen trifluorideNF3
  1594 Trifluoroacetonitrile (Geo)C2NF3
  1595 TrifluoroacetonitrileC2NF3
  1596 TrifluoromethylisocyanideC2NF3
  1597 Trimethyamine-Boron trifluorideH9BC3NF3
  1598 BF3OH, anion (Geo)HBOF3


ΔHf: -123.6 kcal/mol,     REF: E. C. Wu, A. S. Rodgers, J. Phys. Chem.; 78, 2315 (1974).
  
 PM7
CF3CH2.
 H=-123.6 HR=WR1974
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.47785577 +1    0.0000000 +0    0.0000000 +0     1     0     0
  F     1.33486255 +1  114.7181677 +1    0.0000000 +0     2     1     0
  F     1.33476932 +1  114.7666633 +1  120.5785573 +1     2     1     3
  F     1.33647433 +1  113.4293621 +1 -119.7287687 +1     2     1     3
  H     1.07075965 +1  120.8270603 +1   31.3241088 +1     1     2     3
  H     1.07072086 +1  120.8725252 +1 -149.5152318 +1     1     2     3