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

Systemtic Name: 2-(2-methyl-1H-inden-1-id-4-yl)pyridine; zirconium(2+); dichloride Openeye Name: 2-(2-methyl-1H-inden-1-id-4-yl)pyridine; zirconium(2+); dichloride CAS Name: 2-(2-methyl-1H-inden-1-id-4-yl)pyridine; zirconium(2+); dichloride IUPAC Name: 2-(2-methyl-1H-inden-1-id-4-yl)pyridine; zirconium(2+); dichloride Traditional Name: 2-(2-methyl-1H-inden-1-id-4-yl)pyridine; zirconium(2+); dichloride Formula: C60H48Cl2N4Zr2-2 MolecularWeight: 1078.40392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=N3.CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=N3.CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=N3.CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=N3.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=N3.CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=N3.CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=N3.CC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=N3.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/4C15H12N.2ClH.2Zr/c4*1-11-9-12-5-4-6-13(14(12)10-11)15-7-2-3-8-16-15;;;;/h4*2-10H,1H3;2*1H;;/q4*-1;;;2*+2/p-2