Geometry & MOs

Info

ID:	268095
PubChem CID:	103597810
Reduced:	N3O3H19C20 (1)
Stoich.:	A3B3C19D20 (1)
Weight, g/mol:	342.137971
ΔH_f, kcal/mol:	-33.28
Dipole, Da:	4.67
IP(EA), eV:	-8.85(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-fluoro-4-methoxyphenyl)-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]prop-2-enamide

Drug info:

PubChemData

Smile

CNC(=O)CC1=CC=C(C=C1)NC(=O)C=CC2=CC=C(C=C2)OCC#N

DOS

IR

Vibrations