Geometry & MOs

Info

ID:	268342
PubChem CID:	103598991
Reduced:	FN2O3H15C18 (1)
Stoich.:	AB2C3D15E18 (1)
Weight, g/mol:	321.112484
ΔH_f, kcal/mol:	-34.82
Dipole, Da:	5.41
IP(EA), eV:	-9.41(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-fluoro-2-nitrophenyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)prop-2-enamide

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2C1NC(=O)C=CC3=C(C=C(C=C3)F)[N+](=O)[O-]

DOS

IR

Vibrations