2-(3-phenylphenyl)-1H-inden-1-ide; zirconium(4+); dichloride

Systemtic Name: 2-(3-phenylphenyl)-1H-inden-1-ide; zirconium(4+); dichloride Openeye Name: 2-(3-phenylphenyl)-1H-inden-1-ide; zirconium(4+); dichloride CAS Name: 2-(3-phenylphenyl)-1H-inden-1-ide; zirconium(4+); dichloride IUPAC Name: 2-(3-phenylphenyl)-1H-inden-1-ide; zirconium(4+); dichloride Traditional Name: 2-(3-phenylphenyl)-1H-inden-1-ide; zirconium(4+); dichloride Formula: C42H30Cl2Zr MolecularWeight: 696.8176

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C2=CC=CC=C2C=C1C3=CC(=CC=C3)C4=CC=CC=C4.[CH-]1C2=CC=CC=C2C=C1C3=CC(=CC=C3)C4=CC=CC=C4.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

[CH-]1C2=CC=CC=C2C=C1C3=CC(=CC=C3)C4=CC=CC=C4.[CH-]1C2=CC=CC=C2C=C1C3=CC(=CC=C3)C4=CC=CC=C4.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/2C21H15.2ClH.Zr/c2*1-2-7-16(8-3-1)17-11-6-12-20(13-17)21-14-18-9-4-5-10-19(18)15-21;;;/h2*1-15H;2*1H;/q2*-1;;;+4/p-2