Mrv0541 02241205242D          

  4  3  0  0  0  0            999 V2000
    1.2375    0.7145    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 La  0  0  0  0  0  0  0  0  0  0  0  0
    1.2375   -0.7145    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 Br  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
  2  4  1  0  0  0  0
M  END
> <DATABASE_ID>
T3D1737

> <DATABASE_NAME>
t3db

> <SMILES>
Br[La](Br)Br

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

> <INCHI_KEY>
XKUYOJZZLGFZTC-UHFFFAOYSA-K

> <FORMULA>
Br3La

> <MOLECULAR_WEIGHT>
378.617

> <EXACT_MASS>
375.661361101

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_AVERAGE_POLARIZABILITY>
12.659915813546618

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
tribromolanthanum

> <JCHEM_LOGP>
2.8053

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0

> <JCHEM_REFRACTIVITY>
26.205600000000004

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
lanthanum(III) bromide

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D1737

> <NAME>
Lanthanum(III) bromide

> <CAS>
13536-79-3

> <SYNONYMS>
LaBr3; Lanthamum bromide; Lanthanum bromide; Lanthanum bromide (LaBr3); Neodymium Bromide (ndbr3); Tribromolanthanum

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

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