Accuracy

silver(i) iodide   5994 Silver(I) iodide

(Previous)     (Back)     (Next)         Geometry predicted using PM7

    

    #  Species Formula
  5984 Ru(Cp)2I(+) (RUTCIT10) (Geo)C10H10RuI
  5985 Ru(Cp)2I(+) (RUTCIT10)C10H10RuI
  5986 Ru(CO)3(C3H6)IC6H5O3RuI
  5987 Ru(CO)3(C3H6)I (Geo)C6H5O3RuI
  5988 Rhodium(I) iodide (Geo)RhI
  5989 Rhodium(I) iodideRhI
  5990 Rh(III)N4CI (HEFTER) (Geo)C13H19N5O4RhI
  5991 Rh(III)N4CI (HEFTER)C13H19N5O4RhI
  5992 Palladium F I (Geo)FPdI
  5993 Silver(I) iodide (Geo)AgI
  5994 Silver(I) iodide AgI
  5995 Indium iodideInI
  5996 Indium iodide (Geo)InI
  5997 In(III)N2IBrIn (CIHPOY) (Geo)C12H32N4Br3In2I
  5998 In(III)N2IBrIn (CIHPOY)C12H32N4Br3In2I
  5999 Tin iodideSnI
  6000 Tin iodide trihydride (Geo)H3SnI
  6001 Trimethyltin iodide (Geo)C3H9SnI
  6002 Trimethyltin iodideC3H9SnI
  6003 Sb(III)C2I (DOQWEL) (Geo)C2H6SbI
  6004 Sb(III)C2I (DOQWEL)C2H6SbI


Dipole: 5.9 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.: 5.6 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
Silver(I) iodide
 I=5.56 IR=PW91D D=5.91 DR=PW91D DWT=0.2
 Ag     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  I     2.58576915 +1    0.0000000 +0    0.0000000 +0     1     0     0