Mrv0541 02241205242D          

  4  0  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 Fe  0  1  0  0  0  0  0  0  0  0  0  0
    1.0018    0.0000    0.0000 Br  0  5  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 Br  0  5  0  0  0  0  0  0  0  0  0  0
    1.0018   -1.6500    0.0000 Br  0  5  0  0  0  0  0  0  0  0  0  0
M  CHG  4   1   3   2  -1   3  -1   4  -1
M  END
> <DATABASE_ID>
T3D1736

> <DATABASE_NAME>
t3db

> <SMILES>
[Fe+3].[Br-].[Br-].[Br-]

> <INCHI_IDENTIFIER>
InChI=1S/3BrH.Fe/h3*1H;/q;;;+3/p-3

> <INCHI_KEY>
FEONEKOZSGPOFN-UHFFFAOYSA-K

> <FORMULA>
Br3Fe

> <MOLECULAR_WEIGHT>
295.557

> <EXACT_MASS>
292.689955074

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_AVERAGE_POLARIZABILITY>
1.7784

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
iron(3+) ion tribromide

> <JCHEM_LOGP>
-0.77

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
3

> <JCHEM_POLAR_SURFACE_AREA>
0

> <JCHEM_REFRACTIVITY>
0

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
iron(3+) ion tribromide

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D1736

> <NAME>
Iron(III) bromide

> <CAS>
10031-26-2

> <SYNONYMS>
Ferric bromide; Iron bromide (FeBr3); Iron tribromide

> <TYPES>
Inorganic Compound; Bromide Compound; Industrial/Workplace Toxin; Synthetic Compound

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