Accuracy

tungsten(i) iodide   7399 Tungsten(I) iodide

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    #  Species Formula
  7389 Tungsten(VI) hexachloride (Geo)Cl6W
  7390 Tungsten(I) bromideBrW
  7391 Tungsten(I) bromide (Geo)BrW
  7392 WC6 (BMCBCW) (Geo)C6H3O4BrW
  7393 WC6 (BMCBCW)C6H3O4BrW
  7394 Bicyclopentadienyl tungsten dibromideC10H10Br2W
  7395 Tungsten(VI) dibromide dioxideO2Br2W
  7396 Tungsten(VI) dioxide dibromideO2Br2W
  7397 Tungsten(VI) dibromide dioxide (Geo)O2Br2W
  7398 Tungsten(VI) hexabromideBr6W
  7399 Tungsten(I) iodide IW
  7400 Tungsten(I) iodide (Geo)IW
  7401 Bicyclopentadienyl tungsten iodide hydrideC10H11IW
  7402 Bicyclopentadienyl tungsten diiodideC10H10I2W
  7403 Tungsten(VI) diiodide dioxideO2I2W
  7404 Tungsten(VI) diiodide dioxide (Geo)O2I2W
  7405 WC3I2P (BOGBII) (Geo)C7H9O4PI2W
  7406 Tungsten(VI) hexaiodide (Geo)I6W
  7407 W2(CO)10 dianion (Geo)C10O10W2
  7408 W2(CO)10 dianionC10O10W2
  7409 W(IV)2Cl4O6 (BAKFAU)C6H18O6Cl4W2


Dipole: 2.8 Debye,     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.
I.P.: 5.4 eV,     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
Tungsten(I) iodide
 I=5.36 IR=PW91D D=2.75 DR=PW91D
  W     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  I     2.81226867 +1    0.0000000 +0    0.0000000 +0     1     0     0