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

Systemtic Name: 2-(1H-inden-1-id-2-yl)-5-propyl-thiophene; zirconium(4+); dichloride Openeye Name: 2-(1H-inden-1-id-2-yl)-5-propyl-thiophene; zirconium(4+); dichloride CAS Name: 2-(1H-inden-1-id-2-yl)-5-propylthiophene; zirconium(4+); dichloride IUPAC Name: 2-(1H-inden-1-id-2-yl)-5-propylthiophene; zirconium(4+); dichloride Traditional Name: 2-(1H-inden-1-id-2-yl)-5-propyl-thiophene; zirconium(4+); dichloride Formula: C32H30Cl2S2Zr MolecularWeight: 640.8406

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(S1)C2=CC3=CC=CC=C3[CH-]2.CCCC1=CC=C(S1)C2=CC3=CC=CC=C3[CH-]2.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CCCC1=CC=C(S1)C2=CC3=CC=CC=C3[CH-]2.CCCC1=CC=C(S1)C2=CC3=CC=CC=C3[CH-]2.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/2C16H15S.2ClH.Zr/c2*1-2-5-15-8-9-16(17-15)14-10-12-6-3-4-7-13(12)11-14;;;/h2*3-4,6-11H,2,5H2,1H3;2*1H;/q2*-1;;;+4/p-2