1H-inden-1-ide; phenylmethylbenzene; zirconium(3+); dibromide

Systemtic Name: 1H-inden-1-ide; phenylmethylbenzene; zirconium(3+); dibromide Openeye Name: 1H-inden-1-ide; phenylmethylbenzene; zirconium(3+); dibromide CAS Name: 1H-inden-1-ide; phenylmethylbenzene; zirconium(3+); dibromide IUPAC Name: 1H-inden-1-ide; phenylmethylbenzene; zirconium(3+); dibromide Traditional Name: 1H-inden-1-ide; phenylmethylbenzene; zirconium(3+); dibromide Formula: C31H25Br2Zr-2 MolecularWeight: 648.5622

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.C1=CC=C(C=C1)[CH-]C2=CC=CC=C2.[Br-].[Br-].[Zr+3]

Isomeric SMILES

[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.C1=CC=C(C=C1)[CH-]C2=CC=CC=C2.[Br-].[Br-].[Zr+3]

InChI

InChI=1S/C13H11.2C9H7.2BrH.Zr/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;2*1-2-5-9-7-3-6-8(9)4-1;;;/h1-11H;2*1-7H;2*1H;/q3*-1;;;+3/p-2