Geometry & MOs

Info

ID:	268328
PubChem CID:	103598947
Reduced:	ON4H16C18 (1)
Stoich.:	AB4C16D18 (1)
Weight, g/mol:	368.11479
ΔH_f, kcal/mol:	67.69
Dipole, Da:	3.93
IP(EA), eV:	-9.21(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-fluoro-4-methoxyphenyl)-N-[2-(2,2,2-trifluoroethylamino)phenyl]prop-2-enamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CNC(=O)C=CC2=CC=NC=C2)N3C=CN=C3

DOS

IR

Vibrations