Mrv0541 02241204572D          

 11 10  0  0  0  0            999 V2000
    1.7605    1.8414    0.0000 K   0  0  0  0  0  0  0  0  0  0  0  0
    2.4750    1.4289    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1895    1.8414    0.0000 Cr  0  0  0  0  0  0  0  0  0  0  0  0
    3.6020    1.1270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7770    2.5559    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9039    2.2539    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6184    1.8414    0.0000 Cr  0  0  0  0  0  0  0  0  0  0  0  0
    4.2059    1.1270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0309    2.5559    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3329    1.4289    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0474    1.8414    0.0000 K   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3  5  2  0  0  0  0
  3  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  2  0  0  0  0
  7 10  1  0  0  0  0
 10 11  1  0  0  0  0
M  END
> <DATABASE_ID>
T3D0706

> <DATABASE_NAME>
t3db

> <SMILES>
[K]O[Cr](=O)(=O)O[Cr](=O)(=O)O[K]

> <INCHI_IDENTIFIER>
InChI=1S/2Cr.2K.7O

> <INCHI_KEY>
ACIGPAAGFWOCTL-UHFFFAOYSA-N

> <FORMULA>
Cr2K2O7

> <MOLECULAR_WEIGHT>
294.1846

> <EXACT_MASS>
293.772839884

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_AVERAGE_POLARIZABILITY>
14.770115944133304

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
tetraoxo-2,4,6-trioxa-3,5-dichroma-1,7-dipotassaheptane

> <JCHEM_LOGP>
-1.6919999999999997

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
-6.056845553013731

> <JCHEM_POLAR_SURFACE_AREA>
95.97000000000001

> <JCHEM_REFRACTIVITY>
9.822199999999999

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
tetraoxo-2,4,6-trioxa-3,5-dichroma-1,7-dipotassaheptane

> <JCHEM_VEBER_RULE>
0

> <T3DB_ID>
T3D0706

> <NAME>
Potassium dichromate

> <CAS>
7778-50-9

> <SYNONYMS>
Bichromate of potash; Bichromate potassium; Chromium potassium oxide; Dichromate potassium; Dichromic acid dipotassium salt; Dipotassium bichromate; Dipotassium dichromate; Dipotassium dichromium heptaoxide; Iopezite; K bichromate; Potassium bichromate; Potassium dichromate solution; Potassium dichromic acid

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

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