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

Systemtic Name: 2-(1H-inden-1-id-2-yl)thiophene; zirconium(2+); dichloride Openeye Name: 2-(1H-inden-1-id-2-yl)thiophene; zirconium(2+); dichloride CAS Name: 2-(1H-inden-1-id-2-yl)thiophene; zirconium(2+); dichloride IUPAC Name: 2-(1H-inden-1-id-2-yl)thiophene; zirconium(2+); dichloride Traditional Name: 2-(1H-inden-1-id-2-yl)thiophene; zirconium(2+); dichloride Formula: C52H36Cl2S4Zr2-2 MolecularWeight: 1042.45624

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C2=CC=CC=C2C=C1C3=CC=CS3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CS3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CS3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CS3.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

[CH-]1C2=CC=CC=C2C=C1C3=CC=CS3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CS3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CS3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CS3.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/4C13H9S.2ClH.2Zr/c4*1-2-5-11-9-12(8-10(11)4-1)13-6-3-7-14-13;;;;/h4*1-9H;2*1H;;/q4*-1;;;2*+2/p-2