Geometry & MOs

Info

ID:	268345
PubChem CID:	103598997
Reduced:	FN3O5H16C20 (1)
Stoich.:	AB3C5D16E20 (1)
Weight, g/mol:	354.076433
ΔH_f, kcal/mol:	-117.96
Dipole, Da:	3.98
IP(EA), eV:	-8.9(-1.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-fluoro-2-nitrophenyl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]prop-2-enamide

Drug info:

PubChemData

Smile

C1CC(=O)N(C1=O)CC2=CC=C(C=C2)NC(=O)C=CC3=C(C=C(C=C3)F)[N+](=O)[O-]

DOS

IR

Vibrations