Geometry & MOs

Info

ID:	18513
PubChem CID:	542055
Reduced:	HC2O2N3 (2)
Stoich.:	AB2C2D3 (2)
Weight, g/mol:	198.013753
ΔH_f, kcal/mol:	89.95
Dipole, Da:	6.5
IP(EA), eV:	-10.09(-1.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-nitro-1,2,5-oxadiazol-3-yl)-1,3,4-oxadiazol-2-amine

Drug info:

PubChemData

Smile

C1(=NON=C1[N+](=O)[O-])C2=NN=C(O2)N

DOS

IR

Vibrations