iron(2+); pyridazino[1,2-a]cinnoline; sulfate

Systemtic Name: iron(2+); pyridazino[1,2-a]cinnoline; sulfate Openeye Name: ferrous pyridazino[1,2-a]cinnoline sulfate CAS Name: iron(2+); pyridazino[1,2-a]cinnoline; sulfate IUPAC Name: iron(2+); pyridazino[1,2-a]cinnoline; sulfate Traditional Name: ferrous pyridazino[1,2-a]cinnoline sulfate Formula: C12H10FeN2O4S MolecularWeight: 334.1288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN3N2C=CC=C3.[O-]S(=O)(=O)[O-].[Fe+2]

Isomeric SMILES

C1=CC=C2C(=C1)C=CN3N2C=CC=C3.[O-]S(=O)(=O)[O-].[Fe+2]

InChI

InChI=1S/C12H10N2.Fe.H2O4S/c1-2-6-12-11(5-1)7-10-13-8-3-4-9-14(12)13;;1-5(2,3)4/h1-10H;;(H2,1,2,3,4)/q;+2;/p-2