1,2-diethyl-3-methyl-4,5,6,7-tetrahydroinden-1-ide; titanium(2+); trichloride

Systemtic Name: 1,2-diethyl-3-methyl-4,5,6,7-tetrahydroinden-1-ide; titanium(2+); trichloride Openeye Name: 1,2-diethyl-3-methyl-4,5,6,7-tetrahydroinden-1-ide; titanium(2+); trichloride CAS Name: 1,2-diethyl-3-methyl-4,5,6,7-tetrahydroinden-1-ide; titanium(2+); trichloride IUPAC Name: 1,2-diethyl-3-methyl-4,5,6,7-tetrahydroinden-1-ide; titanium(2+); trichloride Traditional Name: 1,2-diethyl-3-methyl-4,5,6,7-tetrahydroinden-1-ide; titanium(2+); trichloride Formula: C42H63Cl3Ti3 MolecularWeight: 817.90962

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Descriptors Computed from Structure

Canonical SMILES:

CC[C-]1C2=C(CCCC2)C(=C1CC)C.CC[C-]1C2=C(CCCC2)C(=C1CC)C.CC[C-]1C2=C(CCCC2)C(=C1CC)C.[Cl-].[Cl-].[Cl-].[Ti+2].[Ti+2].[Ti+2]

Isomeric SMILES

CC[C-]1C2=C(CCCC2)C(=C1CC)C.CC[C-]1C2=C(CCCC2)C(=C1CC)C.CC[C-]1C2=C(CCCC2)C(=C1CC)C.[Cl-].[Cl-].[Cl-].[Ti+2].[Ti+2].[Ti+2]

InChI

InChI=1S/3C14H21.3ClH.3Ti/c3*1-4-11-10(3)13-8-6-7-9-14(13)12(11)5-2;;;;;;/h3*4-9H2,1-3H3;3*1H;;;/q3*-1;;;;3*+2/p-3