Accuracy

vanadium(iii) trichloride   3105 Vanadium(III) trichloride

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

    

    #  Species Formula
  3095 V(V)S6O (BIRYOO10)C9H15O4S6V
  3096 Vanadium(I) chlorideClV
  3097 Vanadium(I) chloride (Geo)ClV
  3098 VCp2Cl (DCPVCL) (Geo)C10H10ClV
  3099 VCp2Cl (DCPVCL)C10H10ClV
  3100 Vanadium(V) chloride dioxideO2ClV
  3101 Vanadium(V) chloride dioxide (Geo)O2ClV
  3102 (h5-Cyclopentadienyl)-dichloro-oxo-vanadium(v) (NIRKUU) (Geo)C5H5OCl2V
  3103 VC5Cl2P2 (CECKIE) (Geo)C11H23P2Cl2V
  3104 V(II)P4Cl2 (DAJDOH) (Geo)C12H32P4Cl2V
  3105 Vanadium(III) trichloride Cl3V
  3106 Vanadium(III) trichloride (Geo)Cl3V
  3107 Vanadium(V) oxychloride (Geo)OCl3V
  3108 V(III)ON2Cl3 (AFUGAJ) (Geo)C20H24N2OCl3V
  3109 V(III)ON2Cl3 (AFUGAJ)C20H24N2OCl3V
  3110 Vanadium(IV) chlorideCl4V
  3111 Vanadium(IV) tetrachloride 2ECl4V
  3112 Vanadium(IV) chloride (Geo)Cl4V
  3113 d2 [V(III)Cl4]- 3A2 -- 3T1 (P)Cl4V
  3114 Vanadium(V) oxide tetrachloride, anion (Geo)OCl4V
  3115 Vanadium(V) pentachlorideCl5V


ΔHf: -72.8 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 UHF TRIPLET PM7
Vanadium(III) trichloride
 H=-72.8 HR=PW91D
  V     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Cl     2.16065078 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Cl     2.15676162 +1  123.7239250 +1    0.0000000 +0     1     2     0
 Cl     2.15622113 +1  123.0110146 +1 -179.7041335 +1     1     2     3