Mrv0541 11251419322D          

  8  5  0  0  0  0            999 V2000
   -1.0607    1.6500    0.0000 Pb  0  2  0  0  0  0  0  0  0  0  0  0
    1.8857    1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0607    1.6500    0.0000 Pb  0  0  0  0  0  0  0  0  0  0  0  0
   -1.0607   -1.6500    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.0607   -0.8250    0.0000 Cr  0  0  0  0  0  0  0  0  0  0  0  0
   -1.0607    0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.2357   -0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8857   -0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  2  0  0  0  0
  5  8  2  0  0  0  0
M  CHG  3   1   2   4  -1   6  -1
M  END
> <DATABASE_ID>
T3D0717

> <DATABASE_NAME>
t3db

> <SMILES>
[Pb++].O=[Pb].[O-][Cr]([O-])(=O)=O

> <INCHI_IDENTIFIER>
InChI=1S/Cr.5O.2Pb/q;;;;2*-1;;+2

> <INCHI_KEY>
BXVHGCHMBBNRBU-UHFFFAOYSA-N

> <FORMULA>
CrO5Pb2

> <MOLECULAR_WEIGHT>
546.4

> <EXACT_MASS>
547.868356714

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
8

> <JCHEM_AVERAGE_POLARIZABILITY>
6.036749270307656

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
λ²-lead(2+) ion dioxochromiumbis(olate) plumbanone

> <ALOGPS_LOGP>
-0.20

> <JCHEM_LOGP>
-2.5252

> <ALOGPS_LOGS>
-0.85

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-2

> <JCHEM_PKA>
3.301029995663981

> <JCHEM_PKA_STRONGEST_ACIDIC>
-2.3010299956639804

> <JCHEM_POLAR_SURFACE_AREA>
80.25999999999999

> <JCHEM_REFRACTIVITY>
5.7716

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
5.32e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
λ²-lead(2+) ion chromate(2-) lead(II) oxide

> <JCHEM_VEBER_RULE>
0

> <T3DB_ID>
T3D0717

> <NAME>
Lead chromate oxide

> <CAS>
18454-12-1

> <SYNONYMS>
Basic chromium lead oxide; Chromic acid lead(2+) salt (1:2); Chromium dilead pentaoxide; Chromium Lead Oxide; Dilead chromate oxide; Lead chromate(VI) oxide; Lead chromic acid oxide

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

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