Mrv0541 02241204082D          

  5  4  0  0  0  0            999 V2000
    0.8250   -0.8250    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 V   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.8250    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.6500    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
M  END
> <DATABASE_ID>
T3D1628

> <DATABASE_NAME>
t3db

> <SMILES>
Cl[V](Cl)(Cl)Cl

> <INCHI_IDENTIFIER>
InChI=1S/4ClH.V/h4*1H;/q;;;;+4/p-4

> <INCHI_KEY>
JTJFQBNJBPPZRI-UHFFFAOYSA-J

> <FORMULA>
Cl4V

> <MOLECULAR_WEIGHT>
192.754

> <EXACT_MASS>
190.819374503

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_AVERAGE_POLARIZABILITY>
11.9607687856034

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
tetrachlorovanadium

> <JCHEM_LOGP>
2.5379999999999994

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0

> <JCHEM_REFRACTIVITY>
24.5452

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
vanadium tetrachloride

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D1628

> <NAME>
Vanadium tetrachloride

> <CAS>
7632-51-1

> <SYNONYMS>
Tetrachlorovanadium; Vanadium chloride; Vanadium chloride (VCl4); Vanadium(IV) chloride; VCl4

> <TYPES>
Inorganic Compound; Vanadium Compound; Industrial/Workplace Toxin; Synthetic Compound

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