Geometry & MOs

Info

ID:	243872
PubChem CID:	99289528
Reduced:	SN3O5C19H19 (1)
Stoich.:	AB3C5D19E19 (1)
Weight, g/mol:	427.066048
ΔH_f, kcal/mol:	-145.3
Dipole, Da:	5.24
IP(EA), eV:	-9.19(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-oxo-1,2-dihydroisoindol-5-yl)-2-[4-(thiophen-2-ylsulfonylamino)phenyl]acetamide

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC2=CC3=C(CNC3=O)C=C2

DOS

IR

Vibrations