bis(4-tert-butylphenyl)-pyridin-2-yl-methanol; dimethylazanide; zirconium(2+)

Systemtic Name: bis(4-tert-butylphenyl)-pyridin-2-yl-methanol; dimethylazanide; zirconium(2+) Openeye Name: bis(4-tert-butylphenyl)-(2-pyridyl)methanol; dimethylazanide; zirconium(2+) CAS Name: bis(4-tert-butylphenyl)-(2-pyridinyl)methanol; dimethylazanide; zirconium(2+) IUPAC Name: bis(4-tert-butylphenyl)-pyridin-2-ylmethanol; dimethylazanide; zirconium(2+) Traditional Name: bis(4-tert-butylphenyl)-(2-pyridyl)methanol; dimethylazanide; zirconium(2+) Formula: C56H74N4O2Zr MolecularWeight: 926.43636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)C(C)(C)C)(C3=CC=CC=N3)O.CC(C)(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)C(C)(C)C)(C3=CC=CC=N3)O.C[N-]C.C[N-]C.[Zr+2]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)C(C)(C)C)(C3=CC=CC=N3)O.CC(C)(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)C(C)(C)C)(C3=CC=CC=N3)O.C[N-]C.C[N-]C.[Zr+2]

InChI

InChI=1S/2C26H31NO.2C2H6N.Zr/c2*1-24(2,3)19-10-14-21(15-11-19)26(28,23-9-7-8-18-27-23)22-16-12-20(13-17-22)25(4,5)6;2*1-3-2;/h2*7-18,28H,1-6H3;2*1-2H3;/q;;2*-1;+2