2-(1-butylsulfanylpropyl)cyclopenta-1,3-diene; titanium(2+); dichloride

Systemtic Name: 2-(1-butylsulfanylpropyl)cyclopenta-1,3-diene; titanium(2+); dichloride Openeye Name: 2-(1-butylsulfanylpropyl)cyclopenta-1,3-diene; titanium(2+); dichloride CAS Name: 2-[1-(butylthio)propyl]cyclopenta-1,3-diene; titanium(2+); dichloride IUPAC Name: 2-(1-butylsulfanylpropyl)cyclopenta-1,3-diene; titanium(2+); dichloride Traditional Name: 2-[1-(butylthio)propyl]cyclopenta-1,3-diene; titanium(2+); dichloride Formula: C24H38Cl2S2Ti2 MolecularWeight: 557.32852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(CC)C1=[C-]CC=C1.CCCCSC(CC)C1=[C-]CC=C1.[Cl-].[Cl-].[Ti+2].[Ti+2]

Isomeric SMILES

CCCCSC(CC)C1=[C-]CC=C1.CCCCSC(CC)C1=[C-]CC=C1.[Cl-].[Cl-].[Ti+2].[Ti+2]

InChI

InChI=1S/2C12H19S.2ClH.2Ti/c2*1-3-5-10-13-12(4-2)11-8-6-7-9-11;;;;/h2*6,8,12H,3-5,7,10H2,1-2H3;2*1H;;/q2*-1;;;2*+2/p-2