Accuracy

gen4f(-) (beglii)   3897 GeN4F(-) (BEGLII)

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    #  Species Formula
  3887 GeO6(+) (ACACGE) (Geo)C15H21O6Ge
  3888 GeO6(+) (ACACGE)C15H21O6Ge
  3889 Germanium fluoride (Geo)FGe
  3890 Germanium fluorideFGe
  3891 FluorogermaneH3FGe
  3892 Fluorogermane (Geo)H3FGe
  3893 Methylgermanium fluoride dihydride (Geo)CH5FGe
  3894 GeNO3F (GAQMEQ) (Geo)C6H12NO3FGe
  3895 GeNO3F (GAQMEQ)C6H12NO3FGe
  3896 GeN4F(-) (BEGLII) (Geo)C12H8O4FGe
  3897 GeN4F(-) (BEGLII) C12H8O4FGe
  3898 Germanium difluoride (Geo)F2Ge
  3899 Germanium difluorideF2Ge
  3900 Dimethylgermanium difluoride (Geo)C2H6F2Ge
  3901 GeC2O2F2 (LIBZAX) (Geo)C14H24N2O2F2Ge
  3902 GeC2O2F2 (LIBZAX)C14H24N2O2F2Ge
  3903 Trifluoromethylgermane (Geo)CH3F3Ge
  3904 MethyltrifluorogermaneCH3F3Ge
  3905 Germanium tetrafluorideF4Ge
  3906 GeF4N2 (HUMCOH) (Geo)C10H10N2F4Ge
  3907 GeF4N2 (HUMCOH)C10H10N2F4Ge


ΔHf: -278.1 kcal/mol,     REF: Estimated from DGauss results of DFT calculations, using the B88-PW91 functional and the DZVP basis set, in CAChe 6.0, Fujitsu Ltd, 2003.
  
 CHARGE=-1 PM7
GeN4F(-) (BEGLII)
 H=-278.1 HR=PW91D
 Ge     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  F     1.38510627 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     1.82180726 +1   95.5965949 +1    0.0000000 +0     1     2     0
  O     1.82292951 +1   95.3758926 +1 -179.9864041 +1     1     2     3
  O     1.79127324 +1  112.8774851 +1   88.5545865 +1     1     2     4
  O     1.79112169 +1  112.7671407 +1 -179.8534675 +1     1     2     5
  C     1.31164489 +1  110.5815715 +1 -110.9747498 +1     3     1     2
  C     1.31969112 +1  111.1873842 +1   93.9131830 +1     5     1     2
  C     1.37986010 +1  124.5819710 +1 -179.0932538 +1     8     5     1
  C     1.40907615 +1  117.9669462 +1 -179.9270355 +1     9     8     5
  C     1.38412974 +1  121.2844135 +1    0.2255230 +1    10     9     8
  C     1.38269966 +1  125.1483118 +1  178.8202655 +1     7     3     1
  C     1.31138399 +1  110.5716471 +1 -110.7852897 +1     4     1     2
  C     1.31966026 +1  111.2156975 +1   93.5664531 +1     6     1     2
  C     1.37972500 +1  124.5776287 +1 -179.0072145 +1    14     6     1
  C     1.40910137 +1  117.9592526 +1 -179.9236813 +1    15    14     6
  C     1.38408861 +1  121.2968742 +1    0.2374701 +1    16    15    14
  C     1.38269883 +1  125.1485444 +1  178.7518895 +1    13     4     1
  H     1.08031122 +1  120.9828201 +1 -179.8091668 +1     9     8    10
  H     1.08308680 +1  118.6636217 +1  179.9697059 +1    10     9    11
  H     1.08381612 +1  119.9439467 +1  179.9952372 +1    11    10     9
  H     1.07980695 +1  120.8107232 +1   -0.3909542 +1    12     7     3
  H     1.08028858 +1  121.0078870 +1 -179.7700190 +1    15    14    16
  H     1.08306076 +1  118.6566919 +1 -179.9959722 +1    16    15    17
  H     1.08377826 +1  119.9493731 +1 -179.9813795 +1    17    16    15
  H     1.07978771 +1  120.8156204 +1   -0.3539634 +1    18    13     4