Geometry & MOs

Info

ID:	6793
PubChem CID:	70022
Reduced:	N2O5H6C7 (1)
Stoich.:	A2B5C6D7 (1)
Weight, g/mol:	198.027671
ΔH_f, kcal/mol:	-91.92
Dipole, Da:	4.37
IP(EA), eV:	-10.65(-2.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(dihydroxyamino)-5-imino-6-oxocyclohexa-1,3-diene-1-carboxylic acid

Drug info:

PubChemData

Smile

C1=C(C=C(C(=O)C1=N)C(=O)O)N(O)O

DOS

IR

Vibrations