Mrv0541 08261423172D          

  2  0  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 Ni  0  0  0  0  0  0  0  0  0  0  0  0
    2.2393    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
M  END
> <DATABASE_ID>
T3D0696

> <DATABASE_NAME>
t3db

> <SMILES>
O.[Ni]

> <INCHI_IDENTIFIER>
InChI=1S/Ni.H2O/h;1H2

> <INCHI_KEY>
SPIFDSWFDKNERT-UHFFFAOYSA-N

> <FORMULA>
H2NiO

> <MOLECULAR_WEIGHT>
76.7087

> <EXACT_MASS>
75.945912608

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
4

> <JCHEM_AVERAGE_POLARIZABILITY>
1.7784

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
hydrate nickel

> <JCHEM_LOGP>
0.156

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0.0

> <JCHEM_REFRACTIVITY>
0.0

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
hydrate nickel

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D0696

> <NAME>
Nickel oxide

> <CAS>
1313-99-1

> <SYNONYMS>
Black nickel oxide; Bunsenite; Dinickel trioxide; Green nickel oxide; Mononickel oxide; Nickel (II) oxide; Nickel (II) oxide, green; Nickel oxide (Ni2O3); Nickel oxide (nio); Nickel oxide peroxide; Nickel oxide sinter 75; Nickel oxide supported on silica; Nickel oxide, nio; Nickel oxide-tungsten oxide; Nickel peroxide; Nickel protoxide; Nickel sesquioxide; Nickel trioxide; Nickel(2+) oxide; Nickel(II) oxide; Nickel(II) oxide (1:1); Nickel(II) oxide, black; Nickel(III) oxide; Nickel(III)oxide; Nickelic oxide; Nickelous oxide

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

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