Accuracy

fluorodinitromethane   1525 Fluorodinitromethane

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    #  Species Formula
  1515 Acetyl fluorideC2H3OF
  1516 Nitrosyl fluoride (Geo)NOF
  1517 Nitrosyl fluorideNOF
  1518 Fluorine dioxideO2F
  1519 Fluorodihydroxyborane (Geo)H2BO2F
  1520 FluorodihydroxyboraneH2BO2F
  1521 p-Fluorobenzoic acidC7H5O2F
  1522 Fluorine nitriteNO2F
  1523 B3O3H2FH2B3O3F
  1524 Fluorine nitrateNO3F
  1525 Fluorodinitromethane HCN2O4F
  1526 FluorodinitrophenylmethaneC7H5N2O4F
  1527 Li(+)(H2O)5.FH10LiO5F
  1528 Li(+)(H2O)5.F (Geo)H10LiO5F
  1529 Fluorine (Geo)F2
  1530 FluorineF2
  1531 Hydrogen fluoride dimer (Geo)H2F2
  1532 Lithium fluoride dimer (Geo)Li2F2
  1533 Lithium fluoride, dimerLi2F2
  1534 Beryllium difluoride (Geo)BeF2
  1535 Beryllium difluorideBeF2


ΔHf: -56.1 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
Fluorodinitromethane
 H=-56.1 HR=NIST
  F     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.33697231 +1    0.0000000 +0    0.0000000 +0     1     0     0
  N     1.52970984 +1  106.2084592 +1    0.0000000 +0     2     1     0
  N     1.52635510 +1  107.4327693 +1 -117.8055909 +1     2     1     3
  O     1.20683253 +1  116.6731119 +1  -10.3026542 +1     4     2     1
  O     1.21200081 +1  115.6883894 +1  171.6378987 +1     4     2     1
  O     1.21045842 +1  115.4361183 +1  126.0817245 +1     3     2     1
  O     1.20696930 +1  116.6416397 +1  -52.4032011 +1     3     2     1
  H     1.13311653 +1  112.4353652 +1  121.0230098 +1     2     1     3