2-pyridin-2-ylpyridine; terbium(3+); tribenzoate

Systemtic Name: 2-pyridin-2-ylpyridine; terbium(3+); tribenzoate Openeye Name: 2-(2-pyridyl)pyridine; terbium(3+); tribenzoate CAS Name: 2-(2-pyridinyl)pyridine; terbium(3+); tribenzoate IUPAC Name: 2-pyridin-2-ylpyridine; terbium(3+); tribenzoate Traditional Name: 2-(2-pyridyl)pyridine; terbium(3+); tribenzoate Formula: C41H31N4O6Tb MolecularWeight: 834.63338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].C1=CC=NC(=C1)C2=CC=CC=N2.C1=CC=NC(=C1)C2=CC=CC=N2.[Tb+3]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].C1=CC=NC(=C1)C2=CC=CC=N2.C1=CC=NC(=C1)C2=CC=CC=N2.[Tb+3]

InChI

InChI=1S/2C10H8N2.3C7H6O2.Tb/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;3*8-7(9)6-4-2-1-3-5-6;/h2*1-8H;3*1-5H,(H,8,9);/q;;;;;+3/p-3