Mrv0541 02241205052D          

 11  8  0  0  0  0            999 V2000
   -0.8250    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 U   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0661    0.7145    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.6536    0.0000    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.0661   -0.7145    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.8286    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4125   -2.3645    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.0000   -3.0789    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.4125   -3.7934    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.8250   -3.0789    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  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
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  2  0  0  0  0
M  CHG  6   4  -1   5   1   6  -1   8  -1   9   1  10  -1
M  END
> <DATABASE_ID>
T3D1181

> <DATABASE_NAME>
t3db

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

> <INCHI_IDENTIFIER>
InChI=1S/2NO3.2O.U/c2*2-1(3)4;;;/q2*-1;;;

> <INCHI_KEY>
QWDZADMNIUIMTC-UHFFFAOYSA-N

> <FORMULA>
N2O8U

> <MOLECULAR_WEIGHT>
394.0375

> <EXACT_MASS>
394.016247569

> <JCHEM_ACCEPTOR_COUNT>
3

> <JCHEM_AVERAGE_POLARIZABILITY>
3.239762129889275

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
-2

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
dioxouranium dinitrate

> <JCHEM_LOGP>
0.02841376366666668

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA_STRONGEST_ACIDIC>
-1.399990368988571

> <JCHEM_PKA_STRONGEST_BASIC>
-6.054117228555776

> <JCHEM_POLAR_SURFACE_AREA>
68.88

> <JCHEM_REFRACTIVITY>
9.8534

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
uranium dioxide dinitrate

> <JCHEM_VEBER_RULE>
0

> <T3DB_ID>
T3D1181

> <NAME>
Uranyl nitrate

> <CAS>
10102-06-4

> <SYNONYMS>
Bis(nitrato)dioxouranium; Bis(nitrato-ko)(dioxo)uranium; Bis(nitrato-o)dioxouranium; Bis(nitrato-o,o')dioxouranium; Dinitratodioxouranium; Uranium nitrate; Uranium oxynitrate; Uranyl dinitrate; Uranyl nitric acid

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

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