Geometry & MOs

Info

ID:	238005
PubChem CID:	92728779
Reduced:	SO3N4H14C17 (1)
Stoich.:	AB3C4D14E17 (1)
Weight, g/mol:	400.120526
ΔH_f, kcal/mol:	54.09
Dipole, Da:	8.87
IP(EA), eV:	-8.47(-1.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-[3-[4-(ethylsulfonylamino)phenyl]-1,2,4-oxadiazol-5-yl]ethyl]benzamide

Drug info:

PubChemData

Smile

CS(=O)(=O)NC1=CC=C(C=C1)C2=NC(=C3C=C4C=CC=CC4=N3)ON2

DOS

IR

Vibrations