Mrv0541 02241205182D          

  2  1  0  0  0  0            999 V2000
    0.8250    0.0000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 Ni  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
M  END
> <DATABASE_ID>
T3D1412

> <DATABASE_NAME>
t3db

> <SMILES>
S=[Ni]

> <INCHI_IDENTIFIER>
InChI=1S/Ni.S

> <INCHI_KEY>
WWNBZGLDODTKEM-UHFFFAOYSA-N

> <FORMULA>
NiS

> <MOLECULAR_WEIGHT>
90.758

> <EXACT_MASS>
89.907418612

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_AVERAGE_POLARIZABILITY>
4.931104615577245

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
sulfanylidenenickel

> <JCHEM_LOGP>
-0.3672

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0

> <JCHEM_REFRACTIVITY>
9.4338

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
sulfanylidenenickel

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D1412

> <NAME>
Nickel sulfide

> <CAS>
11113-75-0

> <SYNONYMS>
Beta nickel sulfide; Millerite; Mononickel monosulfide; Nickel monosulfide; Nickel monosulphide; Nickel sulfide crystalline particles; Nickel sulphide; Nickel(2+) sulfide; Nickelous sulfide

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

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