1H-inden-1-ide; pent-4-enylbenzene; zirconium(3+); dichloride

Systemtic Name: 1H-inden-1-ide; pent-4-enylbenzene; zirconium(3+); dichloride Openeye Name: 1H-inden-1-ide; pent-4-enylbenzene; zirconium(3+); dichloride CAS Name: 1H-inden-1-ide; pent-4-enylbenzene; zirconium(3+); dichloride IUPAC Name: 1H-inden-1-ide; pent-4-enylbenzene; zirconium(3+); dichloride Traditional Name: 1H-inden-1-ide; pent-4-enylbenzene; zirconium(3+); dichloride Formula: C29H27Cl2Zr-2 MolecularWeight: 537.65468

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]=CCCCC1=CC=CC=C1.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[Cl-].[Cl-].[Zr+3]

Isomeric SMILES

[CH-]=CCCCC1=CC=CC=C1.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.[Cl-].[Cl-].[Zr+3]

InChI

InChI=1S/C11H13.2C9H7.2ClH.Zr/c1-2-3-5-8-11-9-6-4-7-10-11;2*1-2-5-9-7-3-6-8(9)4-1;;;/h1-2,4,6-7,9-10H,3,5,8H2;2*1-7H;2*1H;/q3*-1;;;+3/p-2