2-(7-methyl-2-propan-2-yl-1H-inden-1-id-4-yl)pyridine; zirconium(2+); dichloride

Systemtic Name: 2-(7-methyl-2-propan-2-yl-1H-inden-1-id-4-yl)pyridine; zirconium(2+); dichloride Openeye Name: 2-(2-isopropyl-7-methyl-1H-inden-1-id-4-yl)pyridine; zirconium(2+); dichloride CAS Name: 2-(7-methyl-2-propan-2-yl-1H-inden-1-id-4-yl)pyridine; zirconium(2+); dichloride IUPAC Name: 2-(7-methyl-2-propan-2-yl-1H-inden-1-id-4-yl)pyridine; zirconium(2+); dichloride Traditional Name: 2-(2-isopropyl-7-methyl-1H-inden-1-id-4-yl)pyridine; zirconium(2+); dichloride Formula: C36H36Cl2N2Zr2 MolecularWeight: 750.03844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2[CH-]C(=CC2=C(C=C1)C3=CC=CC=N3)C(C)C.CC1=C2[CH-]C(=CC2=C(C=C1)C3=CC=CC=N3)C(C)C.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

CC1=C2[CH-]C(=CC2=C(C=C1)C3=CC=CC=N3)C(C)C.CC1=C2[CH-]C(=CC2=C(C=C1)C3=CC=CC=N3)C(C)C.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

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