PM7 Accuracy

2-fluoropropane   1505 2-Fluoropropane

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    #  Species Formula
  1495 Fluoromethyl, radicalCH2F
  1496 Fluoromethane (Geo)CH3F
  1497 FluoromethaneCH3F
  1498 Fluoroacetylene (Geo)HC2F
  1499 FluoroacetyleneHC2F
  1500 Fluoroethylene (Geo)C2H3F
  1501 FluoroethyleneC2H3F
  1502 CH3CHF, cationC2H4F
  1503 FluoroethaneC2H5F
  1504 Fluoroallene (Geo)C3H3F
  1505 2-Fluoropropane C3H7F
  1506 FluorobenzeneC6H5F
  1507 FluorocyclohexaneC6H11F
  1508 1-FluorononaneC9H19F
  1509 Cyanogen fluorideCNF
  1510 Cyanogen fluoride (Geo)CNF
  1511 Fluorine oxideOF
  1512 Hypofluorous acidHOF
  1513 Lithium hypofluoriteLiOF
  1514 LiF.H2OH2LiOF
  1515 LiF.H2O (Geo)H2LiOF


DHf: -69.4 kcal/mol,     REF: J. O. Cox, G. Pilcher, "Thermochemistry of Organic and Organometallic Compounds," Academic Press, New York, N.Y., 1970.
I.P.: 11.1 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
2-Fluoropropane
 H=-69.4 HR=C&P1970 I=11.08 IR=LLNBS82
  C     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.53084679  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.53024922  1  111.7961042  1    0.0000000  0     1     2     0
  F     1.36176574  1  108.2242408  1 -119.1975178  1     1     2     3
  H     1.12420638  1  110.5758257  1  123.6420681  1     1     2     3
  H     1.09735128  1  111.6505764  1  179.3835209  1     2     1     3
  H     1.09737929  1  111.6588927  1 -179.3699409  1     3     1     2
  H     1.09511347  1  110.9644811  1  -60.6088822  1     2     1     3
  H     1.09743100  1  111.8847841  1   59.4192895  1     2     1     3
  H     1.09516549  1  110.9462842  1   60.6157697  1     3     1     2
  H     1.09749594  1  111.8884528  1  -59.4090624  1     3     1     2