Geometry & MOs

Info

ID:	272497
PubChem CID:	103744002
Reduced:	FO4N5H10C11 (1)
Stoich.:	AB4C5D10E11 (1)
Weight, g/mol:	280.060783
ΔH_f, kcal/mol:	-51.25
Dipole, Da:	5.46
IP(EA), eV:	-9.5(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-2-nitro-N-[2-(1,2,4-oxadiazol-5-yl)ethyl]benzamide

Drug info:

PubChemData

Smile

C1=C(C=C(C(=C1C(=O)NCCC2=NC=NO2)N)[N+](=O)[O-])F

DOS

IR

Vibrations