Geometry & MOs

Info

ID:	139699
PubChem CID:	52581798
Reduced:	Cl2N3O3H19C23 (1)
Stoich.:	A2B3C3D19E23 (1)
Weight, g/mol:	433.095997
ΔH_f, kcal/mol:	-69.38
Dipole, Da:	4.65
IP(EA), eV:	-8.78(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(2-anilino-2-oxoethyl)-1-(3,5-dichlorobenzoyl)-N-methylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CN(CC(=O)NC1=CC=CC=C1)C(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3)Cl)Cl

DOS

IR

Vibrations