N2,N3-bis(oxidanidyl)butane-2,3-diimine; 1H-imidazole; iron

Systemtic Name: N2,N3-bis(oxidanidyl)butane-2,3-diimine; 1H-imidazole; iron Openeye Name: N2,N3-dioxidobutane-2,3-diimine; imidazole; iron CAS Name: N2,N3-dioxidobutane-2,3-diimine; 1H-imidazole; iron IUPAC Name: 2-N,3-N-dioxidobutane-2,3-diimine; 1H-imidazole; iron Traditional Name: glyoxaline; iron; (1-methyl-2-oxidoimino-propylidene)-oxido-amine Formula: C14H20FeN8O4-4 MolecularWeight: 420.2048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=N[O-])C(=N[O-])C.CC(=N[O-])C(=N[O-])C.C1=CN=CN1.C1=CN=CN1.[Fe]

Isomeric SMILES

CC(=N[O-])C(=N[O-])C.CC(=N[O-])C(=N[O-])C.C1=CN=CN1.C1=CN=CN1.[Fe]

InChI

InChI=1S/2C4H8N2O2.2C3H4N2.Fe/c2*1-3(5-7)4(2)6-8;2*1-2-5-3-4-1;/h2*7-8H,1-2H3;2*1-3H,(H,4,5);/p-4