(2-nitrophenyl)methyl-triphenyl-phosphanium; tetrakis(bromanyl)iron

Systemtic Name: (2-nitrophenyl)methyl-triphenyl-phosphanium; tetrakis(bromanyl)iron Openeye Name: (2-nitrophenyl)methyl-triphenyl-phosphonium; tetrabromoiron CAS Name: (2-nitrophenyl)methyl-triphenylphosphonium; tetrabromoiron IUPAC Name: (2-nitrophenyl)methyl-triphenylphosphanium; tetrabromoiron Traditional Name: (2-nitrobenzyl)-triphenyl-phosphonium; tetrabromoiron Formula: C25H21Br4FeNO2P+ MolecularWeight: 773.874501

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CC2=CC=CC=C2[N+](=O)[O-])(C3=CC=CC=C3)C4=CC=CC=C4.[Fe](Br)(Br)(Br)Br

Isomeric SMILES

C1=CC=C(C=C1)[P+](CC2=CC=CC=C2[N+](=O)[O-])(C3=CC=CC=C3)C4=CC=CC=C4.[Fe](Br)(Br)(Br)Br

InChI

InChI=1S/C25H21NO2P.4BrH.Fe/c27-26(28)25-19-11-10-12-21(25)20-29(22-13-4-1-5-14-22,23-15-6-2-7-16-23)24-17-8-3-9-18-24;;;;;/h1-19H,20H2;4*1H;/q+1;;;;;+4/p-4