1,2-dimethyl-4,5,6,7-tetrahydroinden-1-ide; titanium(2+); trichloride

Systemtic Name: 1,2-dimethyl-4,5,6,7-tetrahydroinden-1-ide; titanium(2+); trichloride Openeye Name: 1,2-dimethyl-4,5,6,7-tetrahydroinden-1-ide; titanium(2+); trichloride CAS Name: 1,2-dimethyl-4,5,6,7-tetrahydroinden-1-ide; titanium(2+); trichloride IUPAC Name: 1,2-dimethyl-4,5,6,7-tetrahydroinden-1-ide; titanium(2+); trichloride Traditional Name: 1,2-dimethyl-4,5,6,7-tetrahydroinden-1-ide; titanium(2+); trichloride Formula: C33H45Cl3Ti3 MolecularWeight: 691.6704

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Descriptors Computed from Structure

Canonical SMILES:

C[C-]1C(=CC2=C1CCCC2)C.C[C-]1C(=CC2=C1CCCC2)C.C[C-]1C(=CC2=C1CCCC2)C.[Cl-].[Cl-].[Cl-].[Ti+2].[Ti+2].[Ti+2]

Isomeric SMILES

C[C-]1C(=CC2=C1CCCC2)C.C[C-]1C(=CC2=C1CCCC2)C.C[C-]1C(=CC2=C1CCCC2)C.[Cl-].[Cl-].[Cl-].[Ti+2].[Ti+2].[Ti+2]

InChI

InChI=1S/3C11H15.3ClH.3Ti/c3*1-8-7-10-5-3-4-6-11(10)9(8)2;;;;;;/h3*7H,3-6H2,1-2H3;3*1H;;;/q3*-1;;;;3*+2/p-3