6-(cyclopenta-1,4-dien-1-ylmethyl)-6-ethylsulfanyl-1,3-dimethyl-cyclohexa-1,3-diene; titanium(2+); dichloride

Systemtic Name: 6-(cyclopenta-1,4-dien-1-ylmethyl)-6-ethylsulfanyl-1,3-dimethyl-cyclohexa-1,3-diene; titanium(2+); dichloride Openeye Name: 6-(cyclopenta-1,4-dien-1-ylmethyl)-6-ethylsulfanyl-1,3-dimethyl-cyclohexa-1,3-diene; titanium(2+); dichloride CAS Name: 6-(1-cyclopenta-1,4-dienylmethyl)-6-(ethylthio)-1,3-dimethylcyclohexa-1,3-diene; titanium(2+); dichloride IUPAC Name: 6-(cyclopenta-1,4-dien-1-ylmethyl)-6-ethylsulfanyl-1,3-dimethylcyclohexa-1,3-diene; titanium(2+); dichloride Traditional Name: 6-(cyclopenta-1,4-dien-1-ylmethyl)-6-(ethylthio)-1,3-dimethyl-cyclohexa-1,3-diene; titanium(2+); dichloride Formula: C32H42Cl2S2Ti2 MolecularWeight: 657.44588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1(CC=C(C=C1C)C)CC2=[C-]CC=C2.CCSC1(CC=C(C=C1C)C)CC2=[C-]CC=C2.[Cl-].[Cl-].[Ti+2].[Ti+2]

Isomeric SMILES

CCSC1(CC=C(C=C1C)C)CC2=[C-]CC=C2.CCSC1(CC=C(C=C1C)C)CC2=[C-]CC=C2.[Cl-].[Cl-].[Ti+2].[Ti+2]

InChI

InChI=1S/2C16H21S.2ClH.2Ti/c2*1-4-17-16(12-15-7-5-6-8-15)10-9-13(2)11-14(16)3;;;;/h2*5,7,9,11H,4,6,10,12H2,1-3H3;2*1H;;/q2*-1;;;2*+2/p-2