(2Z)-N-dithiocarboxypyridine-2-carbohydrazonate; iron(3+)

Systemtic Name: (2Z)-N-dithiocarboxypyridine-2-carbohydrazonate; iron(3+) Openeye Name: ferric (2Z)-N-dithiocarboxypyridine-2-carbohydrazonate CAS Name: (2Z)-N-dithiocarboxy-2-pyridinecarbohydrazonate; iron(3+) IUPAC Name: (2Z)-N-dithiocarboxypyridine-2-carbohydrazonate; iron(3+) Traditional Name: ferric (2Z)-N-dithiocarboxypyridine-2-carbohydrazonate Formula: C21H18FeN9O3S6 MolecularWeight: 692.66112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(=NNC(=S)S)[O-].C1=CC=NC(=C1)C(=NNC(=S)S)[O-].C1=CC=NC(=C1)C(=NNC(=S)S)[O-].[Fe+3]

Isomeric SMILES

C1=CC=NC(=C1)/C(=N/NC(=S)S)/[O-].C1=CC=NC(=C1)/C(=N/NC(=S)S)/[O-].C1=CC=NC(=C1)/C(=N/NC(=S)S)/[O-].[Fe+3]

InChI

InChI=1S/3C7H7N3OS2.Fe/c3*11-6(9-10-7(12)13)5-3-1-2-4-8-5;/h3*1-4H,(H,9,11)(H2,10,12,13);/q;;;+3/p-3