CAS 14405-49-3 Tris(dibenzoylmethanato) Iron

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Tris(dibenzoylmethanato) Iron

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Catalog Number

ACM14405493-2

CAS Number

14405-49-3

Product Name

Tris(dibenzoylmethanato) Iron

Structure

Category

Magnetic Metal Complexes

Synonyms

14405-49-3;Tris(dibenzoylmethanato)iron;Iron(III) 1,3-diphenyl-1,3-propanedionate;MFCD00192557;

IUPAC Name

(E)-3-hydroxy-1,3-diphenylprop-2-en-1-one;iron;

Molecular Weight

728.622g/mol

Molecular Formula

C45H36FeO6;

Canonical SMILES

C1=CC=C(C=C1)C(=CC(=O)C2=CC=CC=C2)O.C1=CC=C(C=C1)C(=CC(=O)C2=CC=CC=C2)O.C1=CC=C(C=C1)C(=CC(=O)C2=CC=CC=C2)O.[Fe];

InChI

InChI=1S/3C15H12O2.Fe/c3*16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13;/h3*1-11,16H;/b3*14-11+;;

InChI Key

ZFNORRUERCFEPB-ZYBFZRLBSA-N;

Complexity

994

Covalently-Bonded Unit Count

Defined Bond Stereocenter Count

Exact Mass

728.186g/mol

Heavy Atom Count

Monoisotopic Mass

728.186g/mol

Rotatable Bond Count

Topological Polar Surface Area

112A^2

MSDS

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COA

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Spec Sheet

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