Mrv1572004251606182D          

  4  0  0  0  0  0            999 V2000
    0.4125    0.0000    0.0000 Li  0  3  0  0  0  0  0  0  0  0  0  0
    2.2982    0.0000    0.0000 Ni  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4125    0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
M  CHG  2   1   1   4  -1
M  END
> <DATABASE_ID>
CHEM009564

> <DATABASE_NAME>
chemdb

> <SMILES>
[Li+].O.[OH-].[Ni]

> <INCHI_IDENTIFIER>
InChI=1S/Li.Ni.2H2O/h;;2*1H2/q+1;;;/p-1

> <INCHI_KEY>
FFOWRNSEAJSQMH-UHFFFAOYSA-M

> <FORMULA>
H3LiNiO2

> <MOLECULAR_WEIGHT>
100.66

> <EXACT_MASS>
99.96465

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
7

> <JCHEM_AVERAGE_POLARIZABILITY>
1.7784

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
lithium(1+) ion hydrate nickel hydroxide

> <JCHEM_LOGP>
0.0

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_PKA>
3.55

> <JCHEM_PKA_STRONGEST_ACIDIC>
3.09

> <JCHEM_POLAR_SURFACE_AREA>
0.0

> <JCHEM_REFRACTIVITY>
0.0

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
lithium(1+) ion hydrate nickel hydroxide

> <JCHEM_VEBER_RULE>
1

> <NAME>
Lithium nickel oxide (LiNiO2)

> <CAS>
12031-65-1

$$$$