bis(3,5-dimethylphenyl)-[(1S)-1-(2-diphenylphosphanylcyclopentyl)ethyl]phosphane; iron(2+)

Systemtic Name: bis(3,5-dimethylphenyl)-[(1S)-1-(2-diphenylphosphanylcyclopentyl)ethyl]phosphane; iron(2+) Openeye Name: ferrous bis(3,5-dimethylphenyl)-[(1S)-1-(2-diphenylphosphanylcyclopentyl)ethyl]phosphane CAS Name: bis(3,5-dimethylphenyl)-[(1S)-1-(2-diphenylphosphinocyclopentyl)ethyl]phosphine; iron(2+) IUPAC Name: bis(3,5-dimethylphenyl)-[(1S)-1-(2-diphenylphosphanylcyclopentyl)ethyl]phosphane; iron(2+) Traditional Name: ferrous bis(3,5-dimethylphenyl)-[(1S)-1-(2-diphenylphosphinocyclopentyl)ethyl]phosphine Formula: C70H70FeP4+2 MolecularWeight: 1091.044844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)P(C2=CC(=CC(=C2)C)C)C(C)[C]3[CH][CH][CH][C]3P(C4=CC=CC=C4)C5=CC=CC=C5)C.CC1=CC(=CC(=C1)P(C2=CC(=CC(=C2)C)C)C(C)[C]3[CH][CH][CH][C]3P(C4=CC=CC=C4)C5=CC=CC=C5)C.[Fe+2]

Isomeric SMILES

CC1=CC(=CC(=C1)P(C2=CC(=CC(=C2)C)C)[C@@H](C)[C]3[CH][CH][CH][C]3P(C4=CC=CC=C4)C5=CC=CC=C5)C.CC1=CC(=CC(=C1)P(C2=CC(=CC(=C2)C)C)[C@@H](C)[C]3[CH][CH][CH][C]3P(C4=CC=CC=C4)C5=CC=CC=C5)C.[Fe+2]

InChI

InChI=1S/2C35H35P2.Fe/c2*1-25-19-26(2)22-32(21-25)36(33-23-27(3)20-28(4)24-33)29(5)34-17-12-18-35(34)37(30-13-8-6-9-14-30)31-15-10-7-11-16-31;/h2*6-24,29H,1-5H3;/q;;+2/t2*29-;/m00./s1