Geometry & MOs

Info

ID:	154476
PubChem CID:	56313919
Reduced:	FNO3C21H24 (1)
Stoich.:	ABC3D21E24 (1)
Weight, g/mol:	345.154035
ΔH_f, kcal/mol:	-124.99
Dipole, Da:	5.98
IP(EA), eV:	-8.72(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(3-fluoro-4-methoxyphenyl)-N-[2-(2-fluorophenyl)-2-methylpropyl]prop-2-enamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)/C=C/C1=C(C=C(C=C1)OC)OC)C2=CC=CC=C2F

DOS

IR

Vibrations