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

Systemtic Name: 2-phenyl-1H-inden-1-ide; zirconium(2+); trichloride Openeye Name: 2-phenyl-1H-inden-1-ide; zirconium(2+); trichloride CAS Name: 2-phenyl-1H-inden-1-ide; zirconium(2+); trichloride IUPAC Name: 2-phenyl-1H-inden-1-ide; zirconium(2+); trichloride Traditional Name: 2-phenyl-1H-inden-1-ide; zirconium(2+); trichloride Formula: C45H33Cl3Zr3 MolecularWeight: 953.77452

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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.[Cl-].[Cl-].[Cl-].[Zr+2].[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.[Cl-].[Cl-].[Cl-].[Zr+2].[Zr+2].[Zr+2]

InChI

InChI=1S/3C15H11.3ClH.3Zr/c3*1-2-6-12(7-3-1)15-10-13-8-4-5-9-14(13)11-15;;;;;;/h3*1-11H;3*1H;;;/q3*-1;;;;3*+2/p-3