Geometry & MOs

Info

ID:	69178
PubChem CID:	46530328
Reduced:	ClN2O3C21H21 (1)
Stoich.:	AB2C3D21E21 (1)
Weight, g/mol:	410.195405
ΔH_f, kcal/mol:	-103.01
Dipole, Da:	7.71
IP(EA), eV:	-9.47(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-acetamido-2-methoxyphenyl)-2-[3-(2-oxopyrrolidin-1-yl)anilino]propanamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCCC(=O)NC(C)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations