2-(4-carboxypyridin-2-yl)pyridine-4-carboxylic acid; ethanedioic acid; ruthenium

Systemtic Name: 2-(4-carboxypyridin-2-yl)pyridine-4-carboxylic acid; ethanedioic acid; ruthenium Openeye Name: 2-(4-carboxy-2-pyridyl)pyridine-4-carboxylic acid; oxalic acid; ruthenium CAS Name: 2-(4-carboxy-2-pyridinyl)-4-pyridinecarboxylic acid; oxalic acid; ruthenium IUPAC Name: 2-(4-carboxypyridin-2-yl)pyridine-4-carboxylic acid; oxalic acid; ruthenium Traditional Name: 2-(4-carboxy-2-pyridyl)isonicotinic acid; oxalic acid; ruthenium Formula: C26H18N4O12Ru MolecularWeight: 679.51072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(C=C1C(=O)O)C2=NC=CC(=C2)C(=O)O.C1=CN=C(C=C1C(=O)O)C2=NC=CC(=C2)C(=O)O.C(=O)(C(=O)O)O.[Ru]

Isomeric SMILES

C1=CN=C(C=C1C(=O)O)C2=NC=CC(=C2)C(=O)O.C1=CN=C(C=C1C(=O)O)C2=NC=CC(=C2)C(=O)O.C(=O)(C(=O)O)O.[Ru]

InChI

InChI=1S/2C12H8N2O4.C2H2O4.Ru/c2*15-11(16)7-1-3-13-9(5-7)10-6-8(12(17)18)2-4-14-10;3-1(4)2(5)6;/h2*1-6H,(H,15,16)(H,17,18);(H,3,4)(H,5,6);