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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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