Geometry & MOs

Info

ID:	243869
PubChem CID:	99289511
Reduced:	N2S2O5C19H22 (1)
Stoich.:	A2B2C5D19E22 (1)
Weight, g/mol:	435.125277
ΔH_f, kcal/mol:	-152.89
Dipole, Da:	12.18
IP(EA), eV:	-9.25(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3,4-dimethylphenyl)sulfamoyl]-N-(3-oxo-1,2-dihydroisoindol-5-yl)benzamide

Drug info:

PubChemData

Smile

CS(=O)(=O)CC1=CC(=CC=C1)NC(=O)CCNS(=O)(=O)/C=C/C2=CC=CC=C2

DOS

IR

Vibrations