Accuracy

perfluoromethanol   1620 Perfluoromethanol

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    #  Species Formula
  1610 Carbon tetrafluorideCF4
  1611 Carbon tetrafluoride (Geo)CF4
  1612 Tetrafluoroethylene (Geo)C2F4
  1613 TetrafluoroethyleneC2F4
  1614 1,2,4,5-TetrafluorobenzeneC6H2F4
  1615 1-Fluoro-3-(trifluoro-methyl)benzeneC7H4F4
  1616 TetrafluorohydrazineN2F4
  1617 N,N,N',N'-tetrafluoro-1,1-cyclohexanediamineC6H10N2F4
  1618 N,N,N',N'-Tetrafluoro-4-methyl-1,2-pentaneC6H12N2F4
  1619 1,1-Bis(difluoroamine)heptaneC7H14N2F4
  1620 Perfluoromethanol COF4
  1621 Bis(fluoroxy)perfluoromethaneCO2F4
  1622 PentafluorobenzeneHC6F5
  1623 2,3,4,5,6-PentafluorotolueneC7H3F5
  1624 PentafluoromethylamineCNF5
  1625 PentafluoroguanidineCN3F5
  1626 PentafluorophenolHC6OF5
  1627 Hexafluoroethane (Geo)C2F6
  1628 HexafluoroethaneC2F6
  1629 PerfluorobutadieneC4F6
  1630 HexafluorobenzeneC6F6


ΔHf: -182.8 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
  
 PM7
Perfluoromethanol
 H=-182.8 HR=NIST
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     1.39325431 +1    0.0000000 +0    0.0000000 +0     1     0     0
  F     1.32270798 +1  108.4591183 +1    0.0000000 +0     1     2     0
  F     1.32475676 +1  112.4436146 +1 -119.6503831 +1     1     2     3
  F     1.32478912 +1  112.4140412 +1  119.6082971 +1     1     2     3
  F     1.43462355 +1  105.6219784 +1  179.9884251 +1     2     1     3