4,6-ditert-butyl-2-methyl-pyrimidin-5-olate; dimethylazanide; zirconium(4+)

Systemtic Name: 4,6-ditert-butyl-2-methyl-pyrimidin-5-olate; dimethylazanide; zirconium(4+) Openeye Name: 4,6-ditert-butyl-2-methyl-pyrimidin-5-olate; dimethylazanide; zirconium(4+) CAS Name: 4,6-ditert-butyl-2-methyl-5-pyrimidinolate; dimethylazanide; zirconium(4+) IUPAC Name: 4,6-ditert-butyl-2-methylpyrimidin-5-olate; dimethylazanide; zirconium(4+) Traditional Name: 4,6-ditert-butyl-2-methyl-pyrimidin-5-olate; dimethylazanide; zirconium(4+) Formula: C30H54N6O2Zr MolecularWeight: 622.01276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=N1)C(C)(C)C)[O-])C(C)(C)C.CC1=NC(=C(C(=N1)C(C)(C)C)[O-])C(C)(C)C.C[N-]C.C[N-]C.[Zr+4]

Isomeric SMILES

CC1=NC(=C(C(=N1)C(C)(C)C)[O-])C(C)(C)C.CC1=NC(=C(C(=N1)C(C)(C)C)[O-])C(C)(C)C.C[N-]C.C[N-]C.[Zr+4]

InChI

InChI=1S/2C13H22N2O.2C2H6N.Zr/c2*1-8-14-10(12(2,3)4)9(16)11(15-8)13(5,6)7;2*1-3-2;/h2*16H,1-7H3;2*1-2H3;/q;;2*-1;+4/p-2