1-(1H-inden-1-id-2-ylmethyl)-1,2-dihydroacenaphthylene; zirconium(4+); dichloride

Systemtic Name: 1-(1H-inden-1-id-2-ylmethyl)-1,2-dihydroacenaphthylene; zirconium(4+); dichloride Openeye Name: 1-(1H-inden-1-id-2-ylmethyl)-1,2-dihydroacenaphthylene; zirconium(4+); dichloride CAS Name: 1-(1H-inden-1-id-2-ylmethyl)-1,2-dihydroacenaphthylene; zirconium(4+); dichloride IUPAC Name: 1-(1H-inden-1-id-2-ylmethyl)-1,2-dihydroacenaphthylene; zirconium(4+); dichloride Traditional Name: 1-(1H-inden-1-id-2-ylmethyl)acenaphthene; zirconium(4+); dichloride Formula: C44H34Cl2Zr MolecularWeight: 724.87076

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC3=C2C1=CC=C3)CC4=CC5=CC=CC=C5[CH-]4.C1C(C2=CC=CC3=C2C1=CC=C3)CC4=CC5=CC=CC=C5[CH-]4.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

C1C(C2=CC=CC3=C2C1=CC=C3)CC4=CC5=CC=CC=C5[CH-]4.C1C(C2=CC=CC3=C2C1=CC=C3)CC4=CC5=CC=CC=C5[CH-]4.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/2C22H17.2ClH.Zr/c2*1-2-6-18-12-15(11-17(18)5-1)13-20-14-19-9-3-7-16-8-4-10-21(20)22(16)19;;;/h2*1-12,20H,13-14H2;2*1H;/q2*-1;;;+4/p-2