cerium(3+); (2Z)-2-[nitroso(phenyl)methylidene]-1H-pyridine; chloride

Systemtic Name: cerium(3+); (2Z)-2-[nitroso(phenyl)methylidene]-1H-pyridine; chloride Openeye Name: cerium(3+); (2Z)-2-[nitroso(phenyl)methylene]-1H-pyridine; chloride CAS Name: cerium(3+); (2Z)-2-[nitroso(phenyl)methylidene]-1H-pyridine; chloride IUPAC Name: cerium(3+); (2Z)-2-[nitroso(phenyl)methylidene]-1H-pyridine; chloride Traditional Name: cerium(3+); (2Z)-2-[nitroso(phenyl)methylene]-1H-pyridine; chloride Formula: C36H30CeClN6O3+2 MolecularWeight: 770.2308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C2C=CC=CN2)N=O.C1=CC=C(C=C1)C(=C2C=CC=CN2)N=O.C1=CC=C(C=C1)C(=C2C=CC=CN2)N=O.[Cl-].[Ce+3]

Isomeric SMILES

C1=CC=C(C=C1)/C(=C\2/NC=CC=C2)/N=O.C1=CC=C(C=C1)/C(=C\2/NC=CC=C2)/N=O.C1=CC=C(C=C1)/C(=C\2/NC=CC=C2)/N=O.[Cl-].[Ce+3]

InChI

InChI=1S/3C12H10N2O.Ce.ClH/c3*15-14-12(10-6-2-1-3-7-10)11-8-4-5-9-13-11;;/h3*1-9,13H;;1H/q;;;+3;/p-1/b3*12-11-;;