Accuracy

sb(iii)i4(-) (picoia)   6220 Sb(III)I4(-) (PICOIA)

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    #  Species Formula
  6210 Niobium(V) tetraiodide, cationNbI4
  6211 Rhodium(V) tetraiodide (Geo)RhI4
  6212 Rhodium(V) tetraiodideRhI4
  6213 Palladium(II) tetraiodidePdI4
  6214 Palladium(II) tetraiodide (Geo)PdI4
  6215 Cd(II)I4(2-) (HIBRUF) (Geo)CdI4
  6216 Cd(II)I4(2-) (HIBRUF)CdI4
  6217 In(III)I4(-) (AHOMIT) (Geo)InI4
  6218 In(III)I4(-) (AHOMIT)InI4
  6219 Sb(III)I4(-) (PICOIA) (Geo)SbI4
  6220 Sb(III)I4(-) (PICOIA) SbI4
  6221 Sb2I4Sb2I4
  6222 Sb2I4 (Geo)Sb2I4
  6223 Te(II)I4(2-) (DAMFIG) (Geo)TeI4
  6224 Te(II)I4(2-) (DAMFIG)TeI4
  6225 Te(IV)CI4(-) (IJOJAS) (Geo)C6H5TeI4
  6226 Te(IV)CI4(-) (IJOJAS)C6H5TeI4
  6227 vanadium(V) pentaiodideVI5
  6228 vanadium(V) pentaiodide (Geo)VI5
  6229 Aluminum triiodide (Al2I6) (Geo)Al2I6
  6230 Aluminum triiodide dimerAl2I6


ΔHf: -79.2 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
Sb(III)I4(-) (PICOIA)
 H=-79.2 HR=PW91D
 Sb     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  I     2.80399262 +1    0.0000000 +0    0.0000000 +0     1     0     0
  I     2.92109540 +1   88.7327923 +1    0.0000000 +0     1     2     0
  I     2.92167097 +1   88.7365605 +1 -177.1891708 +1     1     2     3
  I     2.80399182 +1   97.4298006 +1   88.5181838 +1     1     2     4