Mrv1572004161621522D          

 11  0  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 Cr  0  0  0  0  0  0  0  0  0  0  0  0
    1.8857    0.0000    0.0000 Cr  0  0  0  0  0  0  0  0  0  0  0  0
    4.9500    0.0000    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.4125   -1.6500    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.7696   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1268   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3571   -3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7143   -3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1250    0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.4125   -1.6500    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
M  CHG  4   3   1   4   1  10  -1  11  -1
M  END
> <DATABASE_ID>
CHEM000627

> <DATABASE_NAME>
chemdb

> <SMILES>
[NH4+].[NH4+].O.O.O.O.O.[OH-].[OH-].[Cr].[Cr]

> <INCHI_IDENTIFIER>
InChI=1S/2Cr.2H3N.7H2O/h;;2*1H3;7*1H2

> <INCHI_KEY>
ZBNIJSROPKDLFN-UHFFFAOYSA-N

> <FORMULA>
Cr2H20N2O7

> <MOLECULAR_WEIGHT>
264.159

> <EXACT_MASS>
264.008063

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
31

> <JCHEM_AVERAGE_POLARIZABILITY>
1.7784

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
diammonium dichromium pentahydrate dihydroxide

> <ALOGPS_LOGP>
-1.31

> <JCHEM_LOGP>
-0.156

> <ALOGPS_LOGS>
0.18

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0.0

> <JCHEM_REFRACTIVITY>
0.0

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
1.56e+02 g/l

> <JCHEM_TRADITIONAL_IUPAC>
diammonium dichromium pentahydrate dihydroxide

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D0700

> <NAME>
Ammonium dichromate

> <CAS>
7789-09-5

> <SYNONYMS>
(NH4)2CrO7; Ammonium bichromate; Ammonium dichromate (VI); Ammonium dichromic acid; Diammonium dichromate

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

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