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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C2=C(C=C1C3=CC=CC=N3)C(=CC=C2)C4=CC5=CC=CC=C5C=C4.[CH-]1C2=C(C=C1C3=CC=CC=N3)C(=CC=C2)C4=CC5=CC=CC=C5C=C4.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

[CH-]1C2=C(C=C1C3=CC=CC=N3)C(=CC=C2)C4=CC5=CC=CC=C5C=C4.[CH-]1C2=C(C=C1C3=CC=CC=N3)C(=CC=C2)C4=CC5=CC=CC=C5C=C4.[Cl-].[Cl-].[Zr+4]

InChI

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