Geometry & MOs

Info

ID:	268335
PubChem CID:	103598965
Reduced:	FN2O3H17C18 (1)
Stoich.:	AB2C3D17E18 (1)
Weight, g/mol:	346.0965
ΔH_f, kcal/mol:	-52.14
Dipole, Da:	5.47
IP(EA), eV:	-8.87(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-dimethoxyphenyl)-3-(4-fluoro-2-nitrophenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)NC(=O)C=CC2=C(C=C(C=C2)F)[N+](=O)[O-])C

DOS

IR

Vibrations