Mrv0541 08251413502D          

  5  0  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 Co  0  1  0  0  0  0  0  0  0  0  0  0
    1.1196    0.0000    0.0000 Co  0  1  0  0  0  0  0  0  0  0  0  0
    2.1214    0.0000    0.0000 O   0  6  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 O   0  6  0  0  0  0  0  0  0  0  0  0
    1.0018   -1.6500    0.0000 O   0  6  0  0  0  0  0  0  0  0  0  0
M  CHG  5   1   3   2   3   3  -2   4  -2   5  -2
M  END
> <DATABASE_ID>
T3D0667

> <DATABASE_NAME>
t3db

> <SMILES>
[O--].[O--].[O--].[Co+3].[Co+3]

> <INCHI_IDENTIFIER>
InChI=1S/2Co.3O/q2*+3;3*-2

> <INCHI_KEY>
KAGOZRSGIYZEKW-UHFFFAOYSA-N

> <FORMULA>
Co2O3

> <MOLECULAR_WEIGHT>
165.8646

> <EXACT_MASS>
165.851144254

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
5

> <JCHEM_AVERAGE_POLARIZABILITY>
1.7784

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
dicobalt(3+) ion trioxidandiide

> <ALOGPS_LOGP>
1.06

> <JCHEM_LOGP>
0.22999999999999998

> <ALOGPS_LOGS>
-0.66

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
3

> <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

> <ALOGPS_SOLUBILITY>
6.00e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
dicobalt(3+) ion trioxidandiide

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D0667

> <NAME>
Cobalt(III) oxide

> <CAS>
1308-04-9

> <SYNONYMS>
Cobalt peroxide; Cobalt sesqioxide; Cobalt sesquioxide; Cobalt trioxide; Cobalt(3+) oxide; Cobaltic oxide; Dicobalt oxide; Dicobalt trioxide

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

$$$$