Accuracy

titanium tetraiodide   6186 Titanium tetraiodide

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    #  Species Formula
  6176 SbS3I3 (JUYKUJ) (Geo)C6H12S3SbI3
  6177 Carbon tetraiodide (Geo)CI4
  6178 Al(III)I2N2 (DIMAAL) (Geo)C4H12N2Al2I4
  6179 Al(III)I2N2 (DIMAAL)C4H12N2Al2I4
  6180 Silicon tetraiodide (Geo)SiI4
  6181 Silicon tetraiodideSiI4
  6182 SiI2CSi (QUJSET) (Geo)C14H38Si6I4
  6183 SiI2CSi (QUJSET)C14H38Si6I4
  6184 AlS3I (FAMLEK) (Geo)C4H12Al4S6I4
  6185 AlS3I (FAMLEK)C4H12Al4S6I4
  6186 Titanium tetraiodide TiI4
  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 D4hNiI4
  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


ΔHf: -66.3 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
  
 SYMMETRY PM7
Titanium tetraiodide
 H=-66.27 HR=NIST
 
  I     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Ti     2.71479891 +1    0.0000000 +0    0.0000000 +0     1     0     0
  I     2.71479891 +0  109.4712210 +0    0.0000000 +0     2     1     0
  I     2.71479891 +0  109.4712210 +0  120.0000000 +0     2     1     3
  I     2.71479891 +0  109.4712210 +0 -120.0000000 +0     2     1     3
 
   2  1    3    4    5