Mrv0541 02241204562D          

  7  6  0  0  0  0            999 V2000
    1.7605    1.8414    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4750    1.4289    0.0000 As  0  0  0  0  0  0  0  0  0  0  0  0
    3.1895    1.8414    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9039    1.4289    0.0000 Pb  0  0  0  0  0  0  0  0  0  0  0  0
    4.6184    1.8414    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3329    1.4289    0.0000 As  0  0  0  0  0  0  0  0  0  0  0  0
    6.0474    1.8414    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
M  END
> <DATABASE_ID>
T3D0320

> <DATABASE_NAME>
t3db

> <SMILES>
O=[As]O[Pb]O[As]=O

> <INCHI_IDENTIFIER>
InChI=1S/2AsHO2.Pb/c2*2-1-3;/h2*(H,2,3);/q;;+2/p-2

> <INCHI_KEY>
JFOKPVUWYKONLQ-UHFFFAOYSA-L

> <FORMULA>
As2O4Pb

> <MOLECULAR_WEIGHT>
421.0

> <EXACT_MASS>
421.799487172

> <JCHEM_ACCEPTOR_COUNT>
2

> <JCHEM_AVERAGE_POLARIZABILITY>
9.943593209461612

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
bis(arsorosooxy)plumbane

> <JCHEM_LOGP>
1.3696

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
-5.652918605731137

> <JCHEM_POLAR_SURFACE_AREA>
52.6

> <JCHEM_REFRACTIVITY>
5.5862

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
bis(arsorosooxy)plumbane

> <JCHEM_VEBER_RULE>
0

> <T3DB_ID>
T3D0320

> <NAME>
Lead arsenite

> <CAS>
10031-13-7

> <SYNONYMS>
Lead(II) arsenite

> <TYPES>
Inorganic Compound; Metalloid; Arsenic Compound; Lead Compound; Pesticide; Pollutant; Synthetic Compound

$$$$