cyclopentyl-bis[(2-phenylcyclopentyl)methyl]phosphane; iron(2+)

Systemtic Name: cyclopentyl-bis[(2-phenylcyclopentyl)methyl]phosphane; iron(2+) Openeye Name: triferrous cyclopentyl-bis[(2-phenylcyclopentyl)methyl]phosphane CAS Name: cyclopentyl-bis[(2-phenylcyclopentyl)methyl]phosphine; iron(2+) IUPAC Name: cyclopentyl-bis[(2-phenylcyclopentyl)methyl]phosphane; iron(2+) Traditional Name: triferrous cyclopentyl-bis[(2-phenylcyclopentyl)methyl]phosphine Formula: C58H48Fe3P2+6 MolecularWeight: 974.484242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[C]2[CH][CH][CH][C]2CP(C[C]3[CH][CH][CH][C]3C4=CC=CC=C4)[C]5[CH][CH][CH][CH]5.C1=CC=C(C=C1)[C]2[CH][CH][CH][C]2CP(C[C]3[CH][CH][CH][C]3C4=CC=CC=C4)[C]5[CH][CH][CH][CH]5.[Fe+2].[Fe+2].[Fe+2]

Isomeric SMILES

C1=CC=C(C=C1)[C]2[CH][CH][CH][C]2CP(C[C]3[CH][CH][CH][C]3C4=CC=CC=C4)[C]5[CH][CH][CH][CH]5.C1=CC=C(C=C1)[C]2[CH][CH][CH][C]2CP(C[C]3[CH][CH][CH][C]3C4=CC=CC=C4)[C]5[CH][CH][CH][CH]5.[Fe+2].[Fe+2].[Fe+2]

InChI

InChI=1S/2C29H24P.3Fe/c2*1-3-11-23(12-4-1)28-19-9-15-25(28)21-30(27-17-7-8-18-27)22-26-16-10-20-29(26)24-13-5-2-6-14-24;;;/h2*1-20H,21-22H2;;;/q;;3*+2