Accuracy

vanadium(iv) tetracyanide 2e   3018 Vanadium(IV) tetracyanide 2E

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    #  Species Formula
  3008 V, cationV
  3009 Vanadium, atomV
  3010 Bicyclopentadienyl vanadiumC10H10V
  3011 Bicyclopentadienyl vanadium (Geo)C10H10V
  3012 V(Cp)2 (CPNDYV) (Geo)C10H10V
  3013 Dibenzene vanadiumC12H12V
  3014 VC12 (CPLHLV01) (Geo)C12H12V
  3015 VC10 (COGXOL) (Geo)C14H22V
  3016 VC10 (COGXOL)C14H22V
  3017 Vanadium nitrideNV
  3018 Vanadium(IV) tetracyanide 2E C4N4V
  3019 Vanadium(V) pentacyanide (Geo)C5N5V
  3020 Vanadium(V) pentacyanideC5N5V
  3021 V(II)(NH3)6H18N6V
  3022 V(II)(NH3)6 (Geo)H18N6V
  3023 V(IV)(CN)6 2T2gC6N6V
  3024 V(II)N6(2+) (BEQQIX) (Geo)C12H18N6V
  3025 V(II)N6(2+) (BEQQIX)C12H18N6V
  3026 V(0)N6 (DPYRDV) (Geo)C30H24N6V
  3027 V(0)N6 (DPYRDV)C30H24N6V
  3028 Vanadium oxideOV


For electronic state 1,2,E
ΔHf: 0.0 kcal/mol,     REF: Presumed ground state.
  
 SHIFT=80 SYMMETRY OPEN(1,9) MECI ALLVECS PM7
Vanadium(IV) tetracyanide 2E
 ROOT=1,2,E H=0 HR=GS
 
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  V     1.98395105 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.98395105 +0  109.4712210 +0    0.0000000 +0     2     1     0
  C     1.98395105 +0  109.4712210 +0  120.0000000 +0     2     1     3
  C     1.98395105 +0  109.4712210 +0 -120.0000000 +0     2     1     3
  N     1.16223151 +1  180.0000000 +0    0.0000000 +0     1     2     3
  N     1.16223151 +0  180.0000000 +0    0.0000000 +0     3     2     1
  N     1.16223151 +0  180.0000000 +0    0.0000000 +0     4     2     3
  N     1.16223151 +0  180.0000000 +0    0.0000000 +0     5     2     3
 
   2  1    3    4    5
   6  1    7    8    9