di(butan-2-yl)-(4-phenyl-1H-inden-1-id-2-yl)phosphane; titanium(2+); dichloride

Systemtic Name: di(butan-2-yl)-(4-phenyl-1H-inden-1-id-2-yl)phosphane; titanium(2+); dichloride Openeye Name: (4-phenyl-1H-inden-1-id-2-yl)-disec-butyl-phosphane; titanium(2+); dichloride CAS Name: di(butan-2-yl)-(4-phenyl-1H-inden-1-id-2-yl)phosphine; titanium(2+); dichloride IUPAC Name: di(butan-2-yl)-(4-phenyl-1H-inden-1-id-2-yl)phosphane; titanium(2+); dichloride Traditional Name: (4-phenyl-1H-inden-1-id-2-yl)-disec-butyl-phosphine; titanium(2+); dichloride Formula: C92H112Cl2P4Ti2-2 MolecularWeight: 1508.408724

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)P(C1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3)C(C)CC.CCC(C)P(C1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3)C(C)CC.CCC(C)P(C1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3)C(C)CC.CCC(C)P(C1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3)C(C)CC.[Cl-].[Cl-].[Ti+2].[Ti+2]

Isomeric SMILES

CCC(C)P(C1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3)C(C)CC.CCC(C)P(C1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3)C(C)CC.CCC(C)P(C1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3)C(C)CC.CCC(C)P(C1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3)C(C)CC.[Cl-].[Cl-].[Ti+2].[Ti+2]

InChI

InChI=1S/4C23H28P.2ClH.2Ti/c4*1-5-17(3)24(18(4)6-2)21-15-20-13-10-14-22(23(20)16-21)19-11-8-7-9-12-19;;;;/h4*7-18H,5-6H2,1-4H3;2*1H;;/q4*-1;;;2*+2/p-2