Geometry & MOs

Info

ID:	61506
PubChem CID:	26710049
Reduced:	SN2O5C22H26 (1)
Stoich.:	AB2C5D22E26 (1)
Weight, g/mol:	441.03242
ΔH_f, kcal/mol:	-183.7
Dipole, Da:	3.59
IP(EA), eV:	-8.95(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-bromo-1,3-dioxoisoindol-2-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

CCOC(=O)[C@@H]1CCCN(C1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)C

DOS

IR

Vibrations