bis(2-diphenylphosphanylcyclopentyl)methanol; cyclopentane; iron(2+)

Systemtic Name: bis(2-diphenylphosphanylcyclopentyl)methanol; cyclopentane; iron(2+) Openeye Name: diferrous; bis(2-diphenylphosphanylcyclopentyl)methanol; cyclopentane CAS Name: bis(2-diphenylphosphinocyclopentyl)methanol; cyclopentane; iron(2+) IUPAC Name: bis(2-diphenylphosphanylcyclopentyl)methanol; cyclopentane; iron(2+) Traditional Name: diferrous; bis(2-diphenylphosphinocyclopentyl)methanol; cyclopentane Formula: C45H38Fe2OP2+4 MolecularWeight: 768.420142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(C2=CC=CC=C2)[C]3[CH][CH][CH][C]3C([C]4[CH][CH][CH][C]4P(C5=CC=CC=C5)C6=CC=CC=C6)O.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2].[Fe+2]

Isomeric SMILES

C1=CC=C(C=C1)P(C2=CC=CC=C2)[C]3[CH][CH][CH][C]3C([C]4[CH][CH][CH][C]4P(C5=CC=CC=C5)C6=CC=CC=C6)O.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2].[Fe+2]

InChI

InChI=1S/C35H28OP2.2C5H5.2Fe/c36-35(31-23-13-25-33(31)37(27-15-5-1-6-16-27)28-17-7-2-8-18-28)32-24-14-26-34(32)38(29-19-9-3-10-20-29)30-21-11-4-12-22-30;2*1-2-4-5-3-1;;/h1-26,35-36H;2*1-5H;;/q;;;2*+2