Accuracy

sb(iii)cbr2 (kutxus)   5688 Sb(III)CBr2 (KUTXUS)

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    #  Species Formula
  5678 Sb(V)C3Cl2 (CLVISB) (Geo)C6H6Cl5Sb
  5679 Sb(V)OCl5 (ACMEPO) (Geo)C3H9OPCl5Sb
  5680 Sb(V)Cl5O (CURDUO) (Geo)C2H6OSCl5Sb
  5681 Sb(V)Cl5O (CURDUO)C2H6OSCl5Sb
  5682 Sb(V)Cl6(-) (ACCLSB20) (Geo)Cl6Sb
  5683 Sb(V)Cl6(-) (ACCLSB20)Cl6Sb
  5684 SbCl6(-)Cl6Sb
  5685 SbCl6(-) (Geo)Cl6Sb
  5686 Mn(CO)5Sb (BAZPEX) (Geo)C7O5F6MnSb
  5687 Sb(III)CBr2 (KUTXUS) (Geo)C6H5Br2Sb
  5688 Sb(III)CBr2 (KUTXUS) C6H5Br2Sb
  5689 SbOCBr (MBACSB10) (Geo)C7H13O2Br2Sb
  5690 Antimony tribromideBr3Sb
  5691 Sb(III)Br3 (DEJYEW) (Geo)Br3Sb
  5692 Sb(III)Br3 (DEJYEW)Br3Sb
  5693 Antimony tribromide (Geo)Br3Sb
  5694 Sb(V)C2Br3 (DPSBTB) (Geo)C12H10Br3Sb
  5695 Sb(III)CBr4(2-) (BIMKIR) (Geo)C6H5Br4Sb
  5696 Sb(III)CBr4(2-) (BIMKIR)C6H5Br4Sb
  5697 Sb(III)Br5(2-) (CLPYSB) (Geo)Br5Sb
  5698 Sb(III)Br5(2-) (CLPYSB)Br5Sb


ΔHf: 6.0 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
Sb(III)CBr2 (KUTXUS)
 H=6.0 HR=PW91D
 Sb     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Br     2.50495398 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Br     2.50551695 +1   98.6816737 +1    0.0000000 +0     1     2     0
  C     2.15983464 +1   96.3281338 +1  -97.5455527 +1     1     2     3
  C     1.40262225 +1  118.7105137 +1 -128.3167373 +1     4     1     2
  C     1.39735109 +1  120.2587741 +1  179.7526014 +1     5     4     1
  C     1.39127947 +1  120.3297489 +1    0.1318297 +1     6     5     4
  C     1.39316721 +1  119.7268801 +1   -0.1297283 +1     7     6     5
  C     1.39478289 +1  120.3892344 +1    0.0493123 +1     8     7     6
  H     1.09847187 +1  123.4642126 +1 -179.9654584 +1     5     4     6
  H     1.08876145 +1  119.7206510 +1  179.9176153 +1     6     5     7
  H     1.08970708 +1  120.1734256 +1 -179.9442328 +1     7     6     8
  H     1.08947576 +1  119.8724876 +1 -179.9967486 +1     8     7     9
  H     1.09870176 +1  116.2963527 +1 -179.9142376 +1     9     8     7