Geometry & MOs

Info

ID:	61890
PubChem CID:	26715451
Reduced:	FS2N3O5H18C20 (1)
Stoich.:	AB2C3D5E18F20 (1)
Weight, g/mol:	379.120192
ΔH_f, kcal/mol:	-168.88
Dipole, Da:	6.13
IP(EA), eV:	-9.35(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3aR,7aR)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-[4-(methylsulfamoyl)phenyl]acetamide

Drug info:

PubChemData

Smile

CNS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations