Geometry & MOs

Info

ID:	60885
PubChem CID:	26702829
Reduced:	SO3N4H20C25 (1)
Stoich.:	AB3C4D20E25 (1)
Weight, g/mol:	406.075406
ΔH_f, kcal/mol:	-0.11
Dipole, Da:	5.54
IP(EA), eV:	-8.78(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(butylsulfamoyl)phenyl]-5-chloro-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1C=CC2=CC=CC=C2[C@@H]1CC(=O)NN3C=NC4=C(C3=O)C(=CS4)C5=CC=CC=C5

DOS

IR

Vibrations