2-diphenylphosphanyl-N-[2-(2-diphenylphosphanylethylideneamino)-1,2-diphenyl-ethyl]ethanimine; ethanenitrile; iron(2+)

Systemtic Name: 2-diphenylphosphanyl-N-[2-(2-diphenylphosphanylethylideneamino)-1,2-diphenyl-ethyl]ethanimine; ethanenitrile; iron(2+) Openeye Name: ferrous; acetonitrile; 2-diphenylphosphanyl-N-[2-(2-diphenylphosphanylethylideneamino)-1,2-diphenyl-ethyl]ethanimine CAS Name: acetonitrile; 2-diphenylphosphino-N-[2-(2-diphenylphosphinoethylideneamino)-1,2-diphenylethyl]ethanimine; iron(2+) IUPAC Name: acetonitrile; 2-diphenylphosphanyl-N-[2-(2-diphenylphosphanylethylideneamino)-1,2-diphenylethyl]ethanimine; iron(2+) Traditional Name: ferrous; acetonitrile; 2-diphenylphosphinoethylidene-[2-(2-diphenylphosphinoethylideneamino)-1,2-diphenyl-ethyl]amine Formula: C46H44FeN4P2+2 MolecularWeight: 770.660882

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Descriptors Computed from Structure

Canonical SMILES:

CC#N.CC#N.C1=CC=C(C=C1)C(C(C2=CC=CC=C2)N=CCP(C3=CC=CC=C3)C4=CC=CC=C4)N=CCP(C5=CC=CC=C5)C6=CC=CC=C6.[Fe+2]

Isomeric SMILES

CC#N.CC#N.C1=CC=C(C=C1)C(C(C2=CC=CC=C2)N=CCP(C3=CC=CC=C3)C4=CC=CC=C4)N=CCP(C5=CC=CC=C5)C6=CC=CC=C6.[Fe+2]

InChI

InChI=1S/C42H38N2P2.2C2H3N.Fe/c1-7-19-35(20-8-1)41(43-31-33-45(37-23-11-3-12-24-37)38-25-13-4-14-26-38)42(36-21-9-2-10-22-36)44-32-34-46(39-27-15-5-16-28-39)40-29-17-6-18-30-40;2*1-2-3;/h1-32,41-42H,33-34H2;2*1H3;/q;;;+2