dihexyl(1H-inden-1-id-2-yl)phosphane; 1H-inden-1-id-2-yl(dipropyl)phosphane; zirconium(2+); dichloride

Systemtic Name: dihexyl(1H-inden-1-id-2-yl)phosphane; 1H-inden-1-id-2-yl(dipropyl)phosphane; zirconium(2+); dichloride Openeye Name: dihexyl(1H-inden-1-id-2-yl)phosphane; 1H-inden-1-id-2-yl(dipropyl)phosphane; zirconium(2+); dichloride CAS Name: dihexyl(1H-inden-1-id-2-yl)phosphine; 1H-inden-1-id-2-yl(dipropyl)phosphine; zirconium(2+); dichloride IUPAC Name: dihexyl(1H-inden-1-id-2-yl)phosphane; 1H-inden-1-id-2-yl(dipropyl)phosphane; zirconium(2+); dichloride Traditional Name: dihexyl(1H-inden-1-id-2-yl)phosphine; 1H-inden-1-id-2-yl(dipropyl)phosphine; zirconium(2+); dichloride Formula: C72H104Cl2P4Zr2-2 MolecularWeight: 1346.845204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCP(CCCCCC)C1=CC2=CC=CC=C2[CH-]1.CCCCCCP(CCCCCC)C1=CC2=CC=CC=C2[CH-]1.CCCP(CCC)C1=CC2=CC=CC=C2[CH-]1.CCCP(CCC)C1=CC2=CC=CC=C2[CH-]1.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

CCCCCCP(CCCCCC)C1=CC2=CC=CC=C2[CH-]1.CCCCCCP(CCCCCC)C1=CC2=CC=CC=C2[CH-]1.CCCP(CCC)C1=CC2=CC=CC=C2[CH-]1.CCCP(CCC)C1=CC2=CC=CC=C2[CH-]1.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/2C21H32P.2C15H20P.2ClH.2Zr/c2*1-3-5-7-11-15-22(16-12-8-6-4-2)21-17-19-13-9-10-14-20(19)18-21;2*1-3-9-16(10-4-2)15-11-13-7-5-6-8-14(13)12-15;;;;/h2*9-10,13-14,17-18H,3-8,11-12,15-16H2,1-2H3;2*5-8,11-12H,3-4,9-10H2,1-2H3;2*1H;;/q4*-1;;;2*+2/p-2