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

Systemtic Name: 6-(2-cyclopenta-1,4-dien-1-ylpropan-2-yl)-6-ethylsulfanyl-1-methyl-cyclohexa-1,3-diene; titanium(2+); dichloride Openeye Name: 6-(1-cyclopenta-1,4-dien-1-yl-1-methyl-ethyl)-6-ethylsulfanyl-1-methyl-cyclohexa-1,3-diene; titanium(2+); dichloride CAS Name: 6-[2-(1-cyclopenta-1,4-dienyl)propan-2-yl]-6-(ethylthio)-1-methylcyclohexa-1,3-diene; titanium(2+); dichloride IUPAC Name: 6-(2-cyclopenta-1,4-dien-1-ylpropan-2-yl)-6-ethylsulfanyl-1-methylcyclohexa-1,3-diene; titanium(2+); dichloride Traditional Name: 6-(1-cyclopenta-1,4-dien-1-yl-1-methyl-ethyl)-6-(ethylthio)-1-methyl-cyclohexa-1,3-diene; titanium(2+); dichloride Formula: C34H46Cl2S2Ti2 MolecularWeight: 685.49904

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1(CC=CC=C1C)C(C)(C)C2=[C-]CC=C2.CCSC1(CC=CC=C1C)C(C)(C)C2=[C-]CC=C2.[Cl-].[Cl-].[Ti+2].[Ti+2]

Isomeric SMILES

CCSC1(CC=CC=C1C)C(C)(C)C2=[C-]CC=C2.CCSC1(CC=CC=C1C)C(C)(C)C2=[C-]CC=C2.[Cl-].[Cl-].[Ti+2].[Ti+2]

InChI

InChI=1S/2C17H23S.2ClH.2Ti/c2*1-5-18-17(13-9-8-10-14(17)2)16(3,4)15-11-6-7-12-15;;;;/h2*6,8-11H,5,7,13H2,1-4H3;2*1H;;/q2*-1;;;2*+2/p-2