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

Systemtic Name: 2-(4-tert-butyl-1H-inden-1-id-2-yl)pyridine; zirconium(4+); dichloride Openeye Name: 2-(4-tert-butyl-1H-inden-1-id-2-yl)pyridine; zirconium(4+); dichloride CAS Name: 2-(4-tert-butyl-1H-inden-1-id-2-yl)pyridine; zirconium(4+); dichloride IUPAC Name: 2-(4-tert-butyl-1H-inden-1-id-2-yl)pyridine; zirconium(4+); dichloride Traditional Name: 2-(4-tert-butyl-1H-inden-1-id-2-yl)pyridine; zirconium(4+); dichloride Formula: C36H36Cl2N2Zr MolecularWeight: 658.81444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC2=C1C=C([CH-]2)C3=CC=CC=N3.CC(C)(C)C1=CC=CC2=C1C=C([CH-]2)C3=CC=CC=N3.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC(C)(C)C1=CC=CC2=C1C=C([CH-]2)C3=CC=CC=N3.CC(C)(C)C1=CC=CC2=C1C=C([CH-]2)C3=CC=CC=N3.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/2C18H18N.2ClH.Zr/c2*1-18(2,3)16-8-6-7-13-11-14(12-15(13)16)17-9-4-5-10-19-17;;;/h2*4-12H,1-3H3;2*1H;/q2*-1;;;+4/p-2