Geometry & MOs

Info

ID:	60329
PubChem CID:	26683815
Reduced:	Cl2N2O3H18C20 (1)
Stoich.:	A2B2C3D18E20 (1)
Weight, g/mol:	404.069448
ΔH_f, kcal/mol:	-88.57
Dipole, Da:	2.68
IP(EA), eV:	-9.62(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5,6-dichloro-1,3-dioxoisoindol-2-yl)-N-[(2S)-2-phenylbutyl]acetamide

Drug info:

PubChemData

Smile

CC[C@@H](CNC(=O)CN1C(=O)C2=CC(=C(C=C2C1=O)Cl)Cl)C3=CC=CC=C3

DOS

IR

Vibrations