Mrv0541 02241204302D          

  3  2  0  0  0  0            999 V2000
    1.2375   -0.7145    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.9520   -1.1270    0.0000 Ni  0  0  0  0  0  0  0  0  0  0  0  0
    2.6664   -0.7145    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
M  END
> <DATABASE_ID>
T3D0687

> <DATABASE_NAME>
t3db

> <SMILES>
Cl[Ni]Cl

> <INCHI_IDENTIFIER>
InChI=1S/2ClH.Ni/h2*1H;/q;;+2/p-2

> <INCHI_KEY>
QMMRZOWCJAIUJA-UHFFFAOYSA-L

> <FORMULA>
Cl2Ni

> <MOLECULAR_WEIGHT>
129.599

> <EXACT_MASS>
127.873053336

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_AVERAGE_POLARIZABILITY>
7.26531699074483

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
dichloronickel

> <JCHEM_LOGP>
0.5189999999999999

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0

> <JCHEM_REFRACTIVITY>
12.2726

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
nickel chloride

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D0687

> <NAME>
Nickel chloride

> <CAS>
7718-54-9

> <SYNONYMS>
Dichloronickel; Hexahydrate; Ni(II) chloride; Nichel(II) chloride; Nickel (II) chloride; Nickel dichloride; Nickel(2+) chloride; Nickel(II) chloride; Nickelous chloride; NiCl2; [NiCl2]

> <TYPES>
Inorganic Compound; Nickel Compound; Pollutant; Industrial/Workplace Toxin; Synthetic Compound

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