2-(4-naphthalen-1-yl-1H-inden-1-id-2-yl)pyridine; zirconium(4+); dichloride

Systemtic Name: 2-(4-naphthalen-1-yl-1H-inden-1-id-2-yl)pyridine; zirconium(4+); dichloride Openeye Name: 2-[4-(1-naphthyl)-1H-inden-1-id-2-yl]pyridine; zirconium(4+); dichloride CAS Name: 2-[4-(1-naphthalenyl)-1H-inden-1-id-2-yl]pyridine; zirconium(4+); dichloride IUPAC Name: 2-(4-naphthalen-1-yl-1H-inden-1-id-2-yl)pyridine; zirconium(4+); dichloride Traditional Name: 2-[4-(1-naphthyl)-1H-inden-1-id-2-yl]pyridine; zirconium(4+); dichloride Formula: C48H32Cl2N2Zr MolecularWeight: 798.91108

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C2=C(C=C1C3=CC=CC=N3)C(=CC=C2)C4=CC=CC5=CC=CC=C54.[CH-]1C2=C(C=C1C3=CC=CC=N3)C(=CC=C2)C4=CC=CC5=CC=CC=C54.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

[CH-]1C2=C(C=C1C3=CC=CC=N3)C(=CC=C2)C4=CC=CC5=CC=CC=C54.[CH-]1C2=C(C=C1C3=CC=CC=N3)C(=CC=C2)C4=CC=CC5=CC=CC=C54.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/2C24H16N.2ClH.Zr/c2*1-2-10-20-17(7-1)8-5-11-21(20)22-12-6-9-18-15-19(16-23(18)22)24-13-3-4-14-25-24;;;/h2*1-16H;2*1H;/q2*-1;;;+4/p-2