Accuracy

sn(ii)br3(-) (bityae)   5598 Sn(II)Br3(-) (BITYAE)

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    #  Species Formula
  5588 Trimethyltin bromide (Geo)C3H9BrSn
  5589 Trimethyltin bromideC3H9BrSn
  5590 Tri-n-butyltin bromideC12H27BrSn
  5591 Tin dibromide (Geo)Br2Sn
  5592 Tin dibromideBr2Sn
  5593 Dimethyltin dibromide (Geo)C2H6Br2Sn
  5594 Dimethyltin dibromideC2H6Br2Sn
  5595 Sn(IV)S4Br2 (CARSNA) (Geo)C6H10O2S4Br2Sn
  5596 Sn(IV)S4Br2 (CARSNA)C6H10O2S4Br2Sn
  5597 Sn(II)Br3(-) (BITYAE) (Geo)Br3Sn
  5598 Sn(II)Br3(-) (BITYAE) Br3Sn
  5599 Tin tetrabromide (Geo)Br4Sn
  5600 Tin tetrabromideBr4Sn
  5601 Sn(IV)Br6(2-) (BUJPUR) (Geo)Br6Sn
  5602 Sn(IV)Br6(2-) (BUJPUR)Br6Sn
  5603 HexamethylditinC6H18Sn2
  5604 HexaphenyldistannaneC36H30Sn2
  5605 (C6H5)3Sn-O-Sn(c6h5)3C36H30OSn2
  5606 Sn(IV)C3OCl (ACEYIQ) (Geo)C9H24OSCl2Sn2
  5607 Sn(IV)C3OCl (ACEYIQ)C9H24OSCl2Sn2
  5608 Sn(iv)Cl4O2 (GIMYEH) (Geo)H6O4Cl6Sn2


ΔHf: -130.9 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
Sn(II)Br3(-) (BITYAE)
 H=-130.9 HR=PW91D
 Sn     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Br     2.48861992 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Br     2.48972200 +1   95.0919919 +1    0.0000000 +0     1     2     0
 Br     2.48967805 +1   95.0957617 +1   95.5012825 +1     1     2     3