cyclopentane; [2-(diphenylphosphanylmethylidene)cyclohexylidene]methyl-diphenyl-phosphane; zirconium(4+)

Systemtic Name: cyclopentane; [2-(diphenylphosphanylmethylidene)cyclohexylidene]methyl-diphenyl-phosphane; zirconium(4+) Openeye Name: cyclopentane; [2-(diphenylphosphanylmethylene)cyclohexylidene]methyl-diphenyl-phosphane; zirconium(4+) CAS Name: cyclopentane; [2-(diphenylphosphinomethylidene)cyclohexylidene]methyl-diphenylphosphine; zirconium(4+) IUPAC Name: cyclopentane; [2-(diphenylphosphanylmethylidene)cyclohexylidene]methyl-diphenylphosphane; zirconium(4+) Traditional Name: cyclopentane; [2-(diphenylphosphinomethylene)cyclohexylidene]methyl-diphenyl-phosphine; zirconium(4+) Formula: C42H38P2Zr+2 MolecularWeight: 695.922642

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=[C-]P(C2=CC=CC=C2)C3=CC=CC=C3)C(=[C-]P(C4=CC=CC=C4)C5=CC=CC=C5)C1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+4]

Isomeric SMILES

C1CCC(=[C-]P(C2=CC=CC=C2)C3=CC=CC=C3)C(=[C-]P(C4=CC=CC=C4)C5=CC=CC=C5)C1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+4]

InChI

InChI=1S/C32H28P2.2C5H5.Zr/c1-5-17-29(18-6-1)33(30-19-7-2-8-20-30)25-27-15-13-14-16-28(27)26-34(31-21-9-3-10-22-31)32-23-11-4-12-24-32;2*1-2-4-5-3-1;/h1-12,17-24H,13-16H2;2*1-5H;/q-2;;;+4