dihexyl(1H-inden-1-id-2-yl)phosphane; 1H-inden-1-ide; titanium(2+); dichloride

Systemtic Name: dihexyl(1H-inden-1-id-2-yl)phosphane; 1H-inden-1-ide; titanium(2+); dichloride Openeye Name: dihexyl(1H-inden-1-id-2-yl)phosphane; 1H-inden-1-ide; titanium(2+); dichloride CAS Name: dihexyl(1H-inden-1-id-2-yl)phosphine; 1H-inden-1-ide; titanium(2+); dichloride IUPAC Name: dihexyl(1H-inden-1-id-2-yl)phosphane; 1H-inden-1-ide; titanium(2+); dichloride Traditional Name: dihexyl(1H-inden-1-id-2-yl)phosphine; 1H-inden-1-ide; titanium(2+); dichloride Formula: C60H78Cl2P2Ti2-2 MolecularWeight: 1027.848842

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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.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[Cl-].[Cl-].[Ti+2].[Ti+2]

Isomeric SMILES

CCCCCCP(CCCCCC)C1=CC2=CC=CC=C2[CH-]1.CCCCCCP(CCCCCC)C1=CC2=CC=CC=C2[CH-]1.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[Cl-].[Cl-].[Ti+2].[Ti+2]

InChI

InChI=1S/2C21H32P.2C9H7.2ClH.2Ti/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*1-2-5-9-7-3-6-8(9)4-1;;;;/h2*9-10,13-14,17-18H,3-8,11-12,15-16H2,1-2H3;2*1-7H;2*1H;;/q4*-1;;;2*+2/p-2