Accuracy

vanadium(v) pentafluoride   3078 Vanadium(V) pentafluoride

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    #  Species Formula
  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 dioxideO2FV
  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) pentafluoride F5V
  3079 Vanadium pentafluoride (Geo)F5V
  3080 Vanadium(V) hexafluoride (Geo)F6V
  3081 V(IV)F6 2T2gF6V
  3082 V(II)CpCP2 (DACFUI) (Geo)C12H24P2V
  3083 Vanadium sulfide, cation (Geo)SV
  3084 V(IV)O3N2 (BAWBUW) (Geo)C12H18N2O2SV
  3085 V(IV)O3N2 (BAWBUW)C12H18N2O2SV
  3086 VC8S (CUDNIY) (Geo)C10H11O3SV
  3087 VC8S (CUDNIY)C10H11O3SV
  3088 V(IV)O2N3 (ASAVAR) (Geo)C20H16N4O5SV


ΔHf: -348.7 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.
  
 PULAY PM7
Vanadium(V) pentafluoride
 H=-348.7 HR=PW91D
  V     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  F     1.73791622 +1    0.0000000 +0    0.0000000 +0     1     0     0
  F     1.73788491 +1  120.0735317 +1    0.0000000 +0     1     2     0
  F     1.75563853 +1   90.0106828 +1   90.0368587 +1     1     2     3
  F     1.75568843 +1   89.9721736 +1 -179.9723051 +1     1     2     4
  F     1.73788643 +1  119.9372448 +1  -89.9775034 +1     1     2     5