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

Systemtic Name: 5-methyl-2-(4-propan-2-yl-1H-inden-1-id-2-yl)pyridine; zirconium(4+); dichloride Openeye Name: 2-(4-isopropyl-1H-inden-1-id-2-yl)-5-methyl-pyridine; zirconium(4+); dichloride CAS Name: 5-methyl-2-(4-propan-2-yl-1H-inden-1-id-2-yl)pyridine; zirconium(4+); dichloride IUPAC Name: 5-methyl-2-(4-propan-2-yl-1H-inden-1-id-2-yl)pyridine; zirconium(4+); dichloride Traditional Name: 2-(4-isopropyl-1H-inden-1-id-2-yl)-5-methyl-pyridine; zirconium(4+); dichloride Formula: C36H36Cl2N2Zr MolecularWeight: 658.81444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)C2=CC3=C([CH-]2)C=CC=C3C(C)C.CC1=CN=C(C=C1)C2=CC3=C([CH-]2)C=CC=C3C(C)C.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC1=CN=C(C=C1)C2=CC3=C([CH-]2)C=CC=C3C(C)C.CC1=CN=C(C=C1)C2=CC3=C([CH-]2)C=CC=C3C(C)C.[Cl-].[Cl-].[Zr+4]

InChI

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