Geometry & MOs

Info

ID:	268332
PubChem CID:	103598951
Reduced:	ClFN2O3H18C19 (1)
Stoich.:	ABC2D3E18F19 (1)
Weight, g/mol:	372.12407
ΔH_f, kcal/mol:	-126.84
Dipole, Da:	5.45
IP(EA), eV:	-8.65(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-chloro-4-methylanilino)-2-oxoethyl]-3-(2-methoxy-5-methylphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)CNC(=O)C=CC2=CC(=C(C=C2)OC)F)Cl

DOS

IR

Vibrations