Accuracy

geccl3 (bosbiu01)   3944 GeCCl3 (BOSBIU01)

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    #  Species Formula
  3934 Dimethylgermanium dichlorideC2H6Cl2Ge
  3935 Dimethylgermanium dichloride (Geo)C2H6Cl2Ge
  3936 GeCl2S2 (CTTGER) (Geo)C4H8S3Cl2Ge
  3937 GeCl2S2 (CTTGER)C4H8S3Cl2Ge
  3938 GeCl3(-) (FASSUO) (Geo)Cl3Ge
  3939 GeCl3(-) (FASSUO)Cl3Ge
  3940 Trichlorogermane (Geo)HCl3Ge
  3941 Trichloromethylgermane (Geo)CH3Cl3Ge
  3942 TrichloromethylgermaneCH3Cl3Ge
  3943 GeCCl3 (BOSBIU01) (Geo)C3H5O2Cl3Ge
  3944 GeCCl3 (BOSBIU01) C3H5O2Cl3Ge
  3945 Germanium tetrachloride, cationCl4Ge
  3946 Germanium tetrachloride (Geo)Cl4Ge
  3947 Germanium tetrachlorideCl4Ge
  3948 Mn(CO)5Ge (BUSVOA) (Geo)C8O5F9MnGe
  3949 Germanium, dimerGe2
  3950 DigermaneH6Ge2
  3951 Digermane (Geo)H6Ge2
  3952 Hexamethyl digermaneC6H18Ge2
  3953 Hexaethyl digermane (Geo)C12H30Ge2
  3954 Hexaethyl digermaneC12H30Ge2


ΔHf: -201.8 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.
  
 PM7
GeCCl3 (BOSBIU01)
 H=-201.8 HR=PW91D
 Ge     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Cl     2.11141502 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Cl     2.12024377 +1  116.1400024 +1    0.0000000 +0     1     2     0
  C     1.91787058 +1  120.4896818 +1  151.7410622 +1     1     2     3
  O     3.65679830 +1   87.5850847 +1  -80.4376864 +1     4     1     2
  O     2.23438683 +1   47.1149122 +1    7.1703653 +1     5     4     1
  C     1.51687371 +1  110.2060391 +1  -13.1891322 +1     4     1     5
  C     1.22460496 +1   30.6403260 +1   -6.6173777 +1     6     5     4
  H     1.00182780 +1  132.2725284 +1    8.9503096 +1     5     4     6
  H     1.10541547 +1  107.1131983 +1 -122.9836385 +1     4     1     7
  H     1.10530654 +1  106.3748229 +1 -114.2014514 +1     4     1    10
  H     1.11686873 +1  111.3765126 +1  -98.5587576 +1     7     4     1
  H     1.11306079 +1  111.7581946 +1 -116.8859912 +1     7     4    12
 Cl     2.17236713 +1   96.8195998 +1  106.6334165 +1     1     2     4