2-phenyl-1H-inden-1-ide; zirconium(2+); difluoride

Systemtic Name: 2-phenyl-1H-inden-1-ide; zirconium(2+); difluoride Openeye Name: 2-phenyl-1H-inden-1-ide; zirconium(2+); difluoride CAS Name: 2-phenyl-1H-inden-1-ide; zirconium(2+); difluoride IUPAC Name: 2-phenyl-1H-inden-1-ide; zirconium(2+); difluoride Traditional Name: 2-phenyl-1H-inden-1-ide; zirconium(2+); difluoride Formula: C60H44F2Zr2-2 MolecularWeight: 985.436166

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[F-].[F-].[Zr+2].[Zr+2]

Isomeric SMILES

[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[F-].[F-].[Zr+2].[Zr+2]

InChI

InChI=1S/4C15H11.2FH.2Zr/c4*1-2-6-12(7-3-1)15-10-13-8-4-5-9-14(13)11-15;;;;/h4*1-11H;2*1H;;/q4*-1;;;2*+2/p-2