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

Systemtic Name: titanium(2+); 1,2,3-trimethyl-4,5,6,7-tetrahydroinden-1-ide; trichloride Openeye Name: titanium(2+); 1,2,3-trimethyl-4,5,6,7-tetrahydroinden-1-ide; trichloride CAS Name: titanium(2+); 1,2,3-trimethyl-4,5,6,7-tetrahydroinden-1-ide; trichloride IUPAC Name: titanium(2+); 1,2,3-trimethyl-4,5,6,7-tetrahydroinden-1-ide; trichloride Traditional Name: titanium(2+); 1,2,3-trimethyl-4,5,6,7-tetrahydroinden-1-ide; trichloride Formula: C36H51Cl3Ti3 MolecularWeight: 733.75014

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Descriptors Computed from Structure

Canonical SMILES:

C[C-]1C(=C(C2=C1CCCC2)C)C.C[C-]1C(=C(C2=C1CCCC2)C)C.C[C-]1C(=C(C2=C1CCCC2)C)C.[Cl-].[Cl-].[Cl-].[Ti+2].[Ti+2].[Ti+2]

Isomeric SMILES

C[C-]1C(=C(C2=C1CCCC2)C)C.C[C-]1C(=C(C2=C1CCCC2)C)C.C[C-]1C(=C(C2=C1CCCC2)C)C.[Cl-].[Cl-].[Cl-].[Ti+2].[Ti+2].[Ti+2]

InChI

InChI=1S/3C12H17.3ClH.3Ti/c3*1-8-9(2)11-6-4-5-7-12(11)10(8)3;;;;;;/h3*4-7H2,1-3H3;3*1H;;;/q3*-1;;;;3*+2/p-3