1-(3-phenylcyclopenta-1,3-dien-1-yl)-2-propan-2-ylidene-9H-fluoren-9-ide; zirconium(3+); dichloride

Systemtic Name: 1-(3-phenylcyclopenta-1,3-dien-1-yl)-2-propan-2-ylidene-9H-fluoren-9-ide; zirconium(3+); dichloride Openeye Name: 2-isopropylidene-1-(3-phenylcyclopenta-1,3-dien-1-yl)-9H-fluoren-9-ide; zirconium(3+); dichloride CAS Name: 1-(3-phenyl-1-cyclopenta-1,3-dienyl)-2-propan-2-ylidene-9H-fluoren-9-ide; zirconium(3+); dichloride IUPAC Name: 1-(3-phenylcyclopenta-1,3-dien-1-yl)-2-propan-2-ylidene-9H-fluoren-9-ide; zirconium(3+); dichloride Traditional Name: 2-isopropylidene-1-(3-phenylcyclopenta-1,3-dien-1-yl)-9H-fluoren-9-ide; zirconium(3+); dichloride Formula: C27H21Cl2Zr MolecularWeight: 507.58564

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC2=C3C=CC=CC3=[C-]C2=C1C4=CC(=CC4)C5=CC=CC=C5)C.[Cl-].[Cl-].[Zr+3]

Isomeric SMILES

CC(=C1C=CC2=C3C=CC=CC3=[C-]C2=C1C4=CC(=CC4)C5=CC=CC=C5)C.[Cl-].[Cl-].[Zr+3]

InChI

InChI=1S/C27H21.2ClH.Zr/c1-18(2)23-14-15-25-24-11-7-6-10-21(24)17-26(25)27(23)22-13-12-20(16-22)19-8-4-3-5-9-19;;;/h3-12,14-16H,13H2,1-2H3;2*1H;/q-1;;;+3/p-2