PM7 Accuracy Date:Mon Feb 11 04:20:05 2019

diethyl antimony chloride   5660 Diethyl antimony chloride

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    #  Species Formula
  5650 SbF6(-) (Geo)F6Sb
  5651 Triperfluoromethylstibine (Geo)C3F9Sb
  5652 Trisilylstibine (Geo)H9Si3Sb
  5653 SbF5O (SOVWEF) (Geo)HCO3F8SSb
  5654 Sb(III)S4C (CASPER) (Geo)C7H13O2S4Sb
  5655 SbS3 (PYCTSB) (Geo)C15H24N3S6Sb
  5656 SbS3 (FEXLUP) (Geo)C6H9O3S6Sb
  5657 Antimony chlorideClSb
  5658 Dimethyl antimony chloride (Geo)C2H6ClSb
  5659 Dimethyl antimony chlorideC2H6ClSb
  5660 Diethyl antimony chloride C4H10ClSb
  5661 Diethyl antimony chloride (Geo)C4H10ClSb
  5662 Antimony oxychlorideOClSb
  5663 Antimony oxychloride (Geo)OClSb
  5664 Sb(III)S2Cl (CLSSBP10) (Geo)C2H4S2ClSb
  5665 Sb(III)S2Cl (CLSSBP10)C2H4S2ClSb
  5666 SbClS2 (CLSSBP10) (Geo)C2H4S2ClSb
  5667 Antimony dichlorideCl2Sb
  5668 Antimony trichlorideCl3Sb
  5669 Sb(III)Cl3 (ANISBC) (Geo)Cl3Sb
  5670 Antimony trichloride (Geo)Cl3Sb


ΔHf: -30.1 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.
Dipole: 3.4 Debye,     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
Diethyl antimony chloride
 H=-30.1 HR=PW91D D=3.4 DR=PW91D
 Sb     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Cl     2.33850457 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     2.19181819 +1   95.6311573 +1    0.0000000 +0     1     2     0
  C     2.19105490 +1   95.6415513 +1   93.2428229 +1     1     2     3
  H     1.12138773 +1  107.5651367 +1  162.0887423 +1     3     1     2
  C     1.53929792 +1  119.7462278 +1  123.8976766 +1     3     1     5
  H     1.12306138 +1  107.6041941 +1  123.0789486 +1     3     1     6
  C     1.53982964 +1  119.4596195 +1   67.7385745 +1     4     1     2
  H     1.12156338 +1  107.4025159 +1  123.4544485 +1     4     1     8
  H     1.12224639 +1  108.1714786 +1  113.2863065 +1     4     1     9
  H     1.10298517 +1  109.4451653 +1  177.7122049 +1     6     3     1
  H     1.09946866 +1  113.9765190 +1  118.1357361 +1     6     3    11
  H     1.10146541 +1  114.0085792 +1  124.2739070 +1     6     3    12
  H     1.09971885 +1  114.0762684 +1   63.7895440 +1     8     4     1
  H     1.10265429 +1  109.5405403 +1  118.0878538 +1     8     4    14
  H     1.10173503 +1  113.9315164 +1  117.7030817 +1     8     4    15