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

trifluoromethyl, cation   1581 Trifluoromethyl, cation

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    #  Species Formula
  1571 Difluorohydroxyborane (1)HBOF2
  1572 F2BOHHBOF2
  1573 Carbonyl fluorideCOF2
  1574 Carbonyl difluoride (Geo)COF2
  1575 MethoxydifluoroboraneH3BCOF2
  1576 B3O3HF2HB3O3F2
  1577 Lithium fluoride, trimerLi3F3
  1578 Lithium trifluoroberyllateLiBeF3
  1579 Boron trifluoride (Geo)BF3
  1580 Boron trifluorideBF3
  1581 Trifluoromethyl, cation CF3
  1582 TrifluoromethylCF3
  1583 Trifluoromethyl, anionCF3
  1584 Trifluoromethane, cationHCF3
  1585 Trifluoromethane (Geo)HCF3
  1586 TrifluoromethaneHCF3
  1587 TrifluoroethyleneHC2F3
  1588 CF3CH2, cationC2H2F3
  1589 CH2F.CF2, cationC2H2F3
  1590 CF3CH2.C2H2F3
  1591 1,1,1-TrifluoroethaneC2H3F3


ΔHf: 99.3 kcal/mol,     REF: R. J. Blint, T. B. McMahon, J. L. Beauchamp, J. Am. Chem. Soc., 96, 1269 (1974).
  
 CHARGE=1 SYMMETRY PM7
Trifluoromethyl, cation
 H=99.3 HR=BMB1974
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 XX     1.27287530 +1    0.0000000 +0    0.0000000 +0     1     0     0
 XX     1.00000000 +0  120.0000000 +0    0.0000000 +0     2     1     0
  F     1.27287530 +0   89.9999998 +1  180.0000000 +0     1     2     3
  F     1.27287530 +0   89.9999998 +0   60.0000000 +0     1     2     3
  F     1.27287530 +0   89.9999998 +0  -60.0000000 +0     1     2     3