diphenyl-(4-phenyl-1H-inden-1-id-2-yl)phosphane; zirconium(2+); dichloride

Systemtic Name: diphenyl-(4-phenyl-1H-inden-1-id-2-yl)phosphane; zirconium(2+); dichloride Openeye Name: diphenyl-(4-phenyl-1H-inden-1-id-2-yl)phosphane; zirconium(2+); dichloride CAS Name: diphenyl-(4-phenyl-1H-inden-1-id-2-yl)phosphine; zirconium(2+); dichloride IUPAC Name: diphenyl-(4-phenyl-1H-inden-1-id-2-yl)phosphane; zirconium(2+); dichloride Traditional Name: diphenyl-(4-phenyl-1H-inden-1-id-2-yl)phosphine; zirconium(2+); dichloride Formula: C108H80Cl2P4Zr2-2 MolecularWeight: 1755.039844

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C2=C(C=C1P(C3=CC=CC=C3)C4=CC=CC=C4)C(=CC=C2)C5=CC=CC=C5.[CH-]1C2=C(C=C1P(C3=CC=CC=C3)C4=CC=CC=C4)C(=CC=C2)C5=CC=CC=C5.[CH-]1C2=C(C=C1P(C3=CC=CC=C3)C4=CC=CC=C4)C(=CC=C2)C5=CC=CC=C5.[CH-]1C2=C(C=C1P(C3=CC=CC=C3)C4=CC=CC=C4)C(=CC=C2)C5=CC=CC=C5.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

[CH-]1C2=C(C=C1P(C3=CC=CC=C3)C4=CC=CC=C4)C(=CC=C2)C5=CC=CC=C5.[CH-]1C2=C(C=C1P(C3=CC=CC=C3)C4=CC=CC=C4)C(=CC=C2)C5=CC=CC=C5.[CH-]1C2=C(C=C1P(C3=CC=CC=C3)C4=CC=CC=C4)C(=CC=C2)C5=CC=CC=C5.[CH-]1C2=C(C=C1P(C3=CC=CC=C3)C4=CC=CC=C4)C(=CC=C2)C5=CC=CC=C5.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/4C27H20P.2ClH.2Zr/c4*1-4-11-21(12-5-1)26-18-10-13-22-19-25(20-27(22)26)28(23-14-6-2-7-15-23)24-16-8-3-9-17-24;;;;/h4*1-20H;2*1H;;/q4*-1;;;2*+2/p-2