2-(1,2-dimethyl-4H-inden-4-id-2-yl)-5-ethyl-thiophene; zirconium(2+); dichloride

Systemtic Name: 2-(1,2-dimethyl-4H-inden-4-id-2-yl)-5-ethyl-thiophene; zirconium(2+); dichloride Openeye Name: 2-(1,2-dimethyl-4H-inden-4-id-2-yl)-5-ethyl-thiophene; zirconium(2+); dichloride CAS Name: 2-(1,2-dimethyl-4H-inden-4-id-2-yl)-5-ethylthiophene; zirconium(2+); dichloride IUPAC Name: 2-(1,2-dimethyl-4H-inden-4-id-2-yl)-5-ethylthiophene; zirconium(2+); dichloride Traditional Name: 2-(1,2-dimethyl-4H-inden-4-id-2-yl)-5-ethyl-thiophene; zirconium(2+); dichloride Formula: C34H34Cl2S2Zr-2 MolecularWeight: 668.89376

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2(C=C3[C-]=CC=CC3=C2C)C.CCC1=CC=C(S1)C2(C=C3[C-]=CC=CC3=C2C)C.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CCC1=CC=C(S1)C2(C=C3[C-]=CC=CC3=C2C)C.CCC1=CC=C(S1)C2(C=C3[C-]=CC=CC3=C2C)C.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/2C17H17S.2ClH.Zr/c2*1-4-14-9-10-16(18-14)17(3)11-13-7-5-6-8-15(13)12(17)2;;;/h2*5-6,8-11H,4H2,1-3H3;2*1H;/q2*-1;;;+2/p-2