Accuracy

nickel(ii) tetraiodide D4h   6192 Nickel(II) tetraiodide D4h

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    #  Species Formula
  6182 SiI2CSi (QUJSET) (Geo)C14H38Si6I4
  6183 SiI2CSi (QUJSET)C14H38Si6I4
  6184 AlS3I (FAMLEK) (Geo)C4H12Al4S6I4
  6185 AlS3I (FAMLEK)C4H12Al4S6I4
  6186 Titanium tetraiodideTiI4
  6187 Vanadium(IV) iodideVI4
  6188 Cr(III)2(Cp)2I4(0) (KELTAW) (Geo)C20H30Cr2I4
  6189 Cr(III)2I4Cp2 (KELTAW)C20H30Cr2I4
  6190 Fe(III)I4(-) (Geo)FeI4
  6191 Nickel(II) tetraiodide D4h (Geo)NiI4
  6192 Nickel(II) tetraiodide D4h NiI4
  6193 Copper(II) tetraiodide (Geo)CuI4
  6194 Cu(I)2I4(2-) (BIYMIF) (Geo)Cu2I4
  6195 Cu(I)2I4(2-) (BIYMIF)Cu2I4
  6196 Zn(II)I4(2-) (BZDAZP) (Geo)ZnI4
  6197 Zn(II)I4(2-) (BZDAZP)ZnI4
  6198 Ga(III)2I4S2 (DIGZAU) (Geo)C6H14S2Ga2I4
  6199 Ga(III)2I4S2 (DIGZAU)C6H14S2Ga2I4
  6200 Ga(III)4I4S6 (CIFMOT) (Geo)C4H12S6Ga4I4
  6201 Ga(III)4I4S6 (CIFMOT)C4H12S6Ga4I4
  6202 GeI4 (JEDXEV) (Geo)GeI4


ΔHf: -70.0 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.
  
 CHARGE=-2 SYMMETRY PM7
Nickel(II) tetraiodide D4h
 H=-70.0 HR=PW91D
 
 Ni     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  I     2.61095256 +1    0.0000000 +0    0.0000000 +0     1     0     0
  I     2.61095256 +0  180.0000000 +0    0.0000000 +0     1     2     0
  I     2.61095256 +0   90.0000000 +0    0.0000000 +0     1     2     3
  I     2.61095256 +0   90.0000000 +0  180.0000000 +0     1     2     4
 
   2  1    3    4    5