6-(2-cyclopenta-1,4-dien-1-ylpropan-2-yl)-1,3-dimethyl-6-propylsulfanyl-cyclohexa-1,3-diene; titanium(2+); dichloride

Systemtic Name: 6-(2-cyclopenta-1,4-dien-1-ylpropan-2-yl)-1,3-dimethyl-6-propylsulfanyl-cyclohexa-1,3-diene; titanium(2+); dichloride Openeye Name: 6-(1-cyclopenta-1,4-dien-1-yl-1-methyl-ethyl)-1,3-dimethyl-6-propylsulfanyl-cyclohexa-1,3-diene; titanium(2+); dichloride CAS Name: 6-[2-(1-cyclopenta-1,4-dienyl)propan-2-yl]-1,3-dimethyl-6-(propylthio)cyclohexa-1,3-diene; titanium(2+); dichloride IUPAC Name: 6-(2-cyclopenta-1,4-dien-1-ylpropan-2-yl)-1,3-dimethyl-6-propylsulfanylcyclohexa-1,3-diene; titanium(2+); dichloride Traditional Name: 6-(1-cyclopenta-1,4-dien-1-yl-1-methyl-ethyl)-1,3-dimethyl-6-(propylthio)cyclohexa-1,3-diene; titanium(2+); dichloride Formula: C38H54Cl2S2Ti2 MolecularWeight: 741.60536

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1(CC=C(C=C1C)C)C(C)(C)C2=[C-]CC=C2.CCCSC1(CC=C(C=C1C)C)C(C)(C)C2=[C-]CC=C2.[Cl-].[Cl-].[Ti+2].[Ti+2]

Isomeric SMILES

CCCSC1(CC=C(C=C1C)C)C(C)(C)C2=[C-]CC=C2.CCCSC1(CC=C(C=C1C)C)C(C)(C)C2=[C-]CC=C2.[Cl-].[Cl-].[Ti+2].[Ti+2]

InChI

InChI=1S/2C19H27S.2ClH.2Ti/c2*1-6-13-20-19(12-11-15(2)14-16(19)3)18(4,5)17-9-7-8-10-17;;;;/h2*7,9,11,14H,6,8,12-13H2,1-5H3;2*1H;;/q2*-1;;;2*+2/p-2