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

Systemtic Name: ditert-butyl(1H-inden-1-id-2-yl)phosphane; 2-methyl-4-phenyl-1H-inden-1-ide; titanium(2+); dichloride Openeye Name: ditert-butyl(1H-inden-1-id-2-yl)phosphane; 2-methyl-4-phenyl-1H-inden-1-ide; titanium(2+); dichloride CAS Name: ditert-butyl(1H-inden-1-id-2-yl)phosphine; 2-methyl-4-phenyl-1H-inden-1-ide; titanium(2+); dichloride IUPAC Name: ditert-butyl(1H-inden-1-id-2-yl)phosphane; 2-methyl-4-phenyl-1H-inden-1-ide; titanium(2+); dichloride Traditional Name: ditert-butyl(1H-inden-1-id-2-yl)phosphine; 2-methyl-4-phenyl-1H-inden-1-ide; titanium(2+); dichloride Formula: C66H74Cl2P2Ti2-2 MolecularWeight: 1095.881282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.CC(C)(C)P(C1=CC2=CC=CC=C2[CH-]1)C(C)(C)C.CC(C)(C)P(C1=CC2=CC=CC=C2[CH-]1)C(C)(C)C.[Cl-].[Cl-].[Ti+2].[Ti+2]

Isomeric SMILES

CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.CC(C)(C)P(C1=CC2=CC=CC=C2[CH-]1)C(C)(C)C.CC(C)(C)P(C1=CC2=CC=CC=C2[CH-]1)C(C)(C)C.[Cl-].[Cl-].[Ti+2].[Ti+2]

InChI

InChI=1S/2C17H24P.2C16H13.2ClH.2Ti/c2*1-16(2,3)18(17(4,5)6)15-11-13-9-7-8-10-14(13)12-15;2*1-12-10-14-8-5-9-15(16(14)11-12)13-6-3-2-4-7-13;;;;/h2*7-12H,1-6H3;2*2-11H,1H3;2*1H;;/q4*-1;;;2*+2/p-2