Accuracy

vanadium(v) fluoride dioxide   3072 Vanadium(V) fluoride dioxide

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    #  Species Formula
  3062 V(V)O6(3-) (AOXOVA) (Geo)C4O10V
  3063 V(V)O6(3-) (AOXOVA)C4O10V
  3064 V(IV)O6(2-) (AOXVAN10) (Geo)C4H2O10V
  3065 V(IV)O6(2-) (AOXVAN10)C4H2O10V
  3066 V(III)O6(-) (DABKEW) (Geo)C4H4O10V
  3067 V(III)O6(-) (DABKEW)C4H4O10V
  3068 V(IV)O5(2-) (AJUJEU) (Geo)C6H6O10V
  3069 V(IV)O5(2-) (AJUJEU)C6H6O10V
  3070 Vanadium(I) fluorideFV
  3071 Vanadium(I) fluoride (Geo)FV
  3072 Vanadium(V) fluoride dioxide O2FV
  3073 Vanadium(V) fluoride dioxide (Geo)O2FV
  3074 Vanadium(III) trifluorideF3V
  3075 Vanadium(III) fluoride (Geo)F3V
  3076 Vanadium(V) oxyfluoride (Geo)OF3V
  3077 Vanadium(IV) tetrafluoride 2EF4V
  3078 Vanadium(V) pentafluorideF5V
  3079 Vanadium pentafluoride (Geo)F5V
  3080 Vanadium(V) hexafluoride (Geo)F6V
  3081 V(IV)F6 2T2gF6V
  3082 V(II)CpCP2 (DACFUI) (Geo)C12H24P2V


Dipole: 3.5 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.: 7.7 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.
  
 PULAY PM7
Vanadium(V) fluoride dioxide
 I=7.67 IR=PW91D D=3.51 DR=PW91D
  V     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  F     1.72657597 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     1.54975780 +1  118.7157871 +1    0.0000000 +0     1     2     0
  O     1.54972011 +1  118.6979906 +1  173.7294072 +1     1     2     3