diphenyl-(1-phenyl-4,5,6,7-tetrahydroinden-2-yl)phosphane; iron(2+)

Systemtic Name: diphenyl-(1-phenyl-4,5,6,7-tetrahydroinden-2-yl)phosphane; iron(2+) Openeye Name: ferrous diphenyl-(1-phenyl-4,5,6,7-tetrahydroinden-2-yl)phosphane CAS Name: diphenyl-(1-phenyl-4,5,6,7-tetrahydroinden-2-yl)phosphine; iron(2+) IUPAC Name: diphenyl-(1-phenyl-4,5,6,7-tetrahydroinden-2-yl)phosphane; iron(2+) Traditional Name: ferrous diphenyl-(1-phenyl-4,5,6,7-tetrahydroinden-2-yl)phosphine Formula: C54H48FeP2+2 MolecularWeight: 814.751442

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[C]2[C](C1)[CH][C]([C]2C3=CC=CC=C3)P(C4=CC=CC=C4)C5=CC=CC=C5.C1CC[C]2[C](C1)[CH][C]([C]2C3=CC=CC=C3)P(C4=CC=CC=C4)C5=CC=CC=C5.[Fe+2]

Isomeric SMILES

C1CC[C]2[C](C1)[CH][C]([C]2C3=CC=CC=C3)P(C4=CC=CC=C4)C5=CC=CC=C5.C1CC[C]2[C](C1)[CH][C]([C]2C3=CC=CC=C3)P(C4=CC=CC=C4)C5=CC=CC=C5.[Fe+2]

InChI

InChI=1S/2C27H24P.Fe/c2*1-4-12-21(13-5-1)27-25-19-11-10-14-22(25)20-26(27)28(23-15-6-2-7-16-23)24-17-8-3-9-18-24;/h2*1-9,12-13,15-18,20H,10-11,14,19H2;/q;;+2