Mrv0541 02241205052D          

 11  8  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
    1.0018    0.0000    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
   -1.0320   -4.1250    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.3175   -3.7125    0.0000 U   0  0  0  0  0  0  0  0  0  0  0  0
    0.0950   -4.4270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7300   -2.9980    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3969   -3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3969   -2.4750    0.0000 U   0  0  0  0  0  0  0  0  0  0  0  0
    0.3969   -1.6500    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.2219   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4281   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  2  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  8 11  2  0  0  0  0
M  CHG  4   1   1   2   1   3  -1   9  -1
M  END
> <DATABASE_ID>
T3D1161

> <DATABASE_NAME>
t3db

> <SMILES>
[Na+].[Na+].[O-][U](=O)(=O)O[U]([O-])(=O)=O

> <INCHI_IDENTIFIER>
InChI=1S/2Na.7O.2U/q2*+1;;;;;;2*-1;;

> <INCHI_KEY>
FJBIAWYRFOSYRU-UHFFFAOYSA-N

> <FORMULA>
Na2O7U2

> <MOLECULAR_WEIGHT>
634.0332

> <EXACT_MASS>
634.04550687

> <JCHEM_ACCEPTOR_COUNT>
6

> <JCHEM_AVERAGE_POLARIZABILITY>
11.082540017698836

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
disodium [(oxidodioxouranio)oxy]uraniumoylolate

> <JCHEM_LOGP>
-2.2068

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
13.068098864628887

> <JCHEM_PKA_STRONGEST_ACIDIC>
12.407342712452458

> <JCHEM_POLAR_SURFACE_AREA>
123.63

> <JCHEM_REFRACTIVITY>
10.0076

> <JCHEM_ROTATABLE_BOND_COUNT>
2

> <JCHEM_RULE_OF_FIVE>
0

> <JCHEM_TRADITIONAL_IUPAC>
disodium [(oxidodioxouranio)oxy]uraniumoylolate

> <JCHEM_VEBER_RULE>
0

> <T3DB_ID>
T3D1161

> <NAME>
Sodium uranate

> <CAS>
13721-34-1

> <SYNONYMS>
Sodium uranic acid; Sodium uranium oxide (Na2U2O7)

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

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