Geometry & MOs

Info

ID:	5522
PubChem CID:	13273
Reduced:	N3H5O5C8 (1)
Stoich.:	A3B5C5D8 (1)
Weight, g/mol:	223.02292
ΔH_f, kcal/mol:	-30.92
Dipole, Da:	2.77
IP(EA), eV:	-9.92(-2.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-(5-nitrofuran-2-yl)ethenyl]-3H-1,3,4-oxadiazol-2-one

Drug info:

PubChemData

Smile

C1=C(OC(=C1)[N+](=O)[O-])C=CC2=NNC(=O)O2

DOS

IR

Vibrations