Mrv0541 02241205272D          

 14  6  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 Cl  0  5  0  0  0  0  0  0  0  0  0  0
    1.0018    0.0000    0.0000 Cl  0  5  0  0  0  0  0  0  0  0  0  0
    2.0036    0.0000    0.0000 Cl  0  5  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 Cl  0  5  0  0  0  0  0  0  0  0  0  0
    1.0018   -1.6500    0.0000 Cl  0  5  0  0  0  0  0  0  0  0  0  0
    2.0036   -1.6500    0.0000 Cl  0  5  0  0  0  0  0  0  0  0  0  0
    0.0000   -4.1165    0.0000 Sb  0  0  0  0  0 15  0  0  0  0  0  0
    4.7143   -4.7289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3018   -4.0145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4768   -4.0145    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    3.0643   -3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2393   -3.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0643   -4.7289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2393   -4.7289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 10 13  1  0  0  0  0
 13 14  1  0  0  0  0
M  CHG  7   1  -1   2  -1   3  -1   4  -1   5  -1   6  -1  10   1
M  END
> <DATABASE_ID>
T3D1887

> <DATABASE_NAME>
t3db

> <SMILES>
[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Cl-].[Sb].CC[O+](CC)CC

> <INCHI_IDENTIFIER>
InChI=1S/C6H15O.6ClH.Sb/c1-4-7(5-2)6-3;;;;;;;/h4-6H2,1-3H3;6*1H;/q+1;;;;;;;/p-6

> <INCHI_KEY>
FZRSYYBOMFEFJV-UHFFFAOYSA-H

> <FORMULA>
C6H15Cl6OSb

> <MOLECULAR_WEIGHT>
437.66

> <EXACT_MASS>
433.829224388

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_AVERAGE_POLARIZABILITY>
13.359860097106502

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
-5

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
triethyloxidanium stibanylidyne hexachloride

> <JCHEM_LOGP>
0.5889999999999997

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
1

> <JCHEM_POLAR_SURFACE_AREA>
13.59

> <JCHEM_REFRACTIVITY>
44.4508

> <JCHEM_ROTATABLE_BOND_COUNT>
3

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
triethyloxidanium stibanylidyne hexachloride

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D1887

> <NAME>
Triethyloxonium hexachloroantimonate

> <CAS>
3264-67-3

> <SYNONYMS>
Oxonium, triethyl-, (OC-6-11)-hexachloroantimonate(1-); Triethyloxonium hexachloroantimonate(1-); Triethyloxonium hexachloroantimonic acid

> <TYPES>
Organic Compound; Antimony Compound; Organometallic; Pollutant; Food Toxin; Synthetic Compound

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