Geometry & MOs

Info

ID:	70294
PubChem CID:	48413150
Reduced:	S2N3O3C16H17 (1)
Stoich.:	A2B3C3D16E17 (1)
Weight, g/mol:	402.099791
ΔH_f, kcal/mol:	-3.73
Dipole, Da:	5.93
IP(EA), eV:	-9.46(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-methyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)propyl]-2-nitrobenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)C(C1=NC(=NO1)C2=CC=CC=C2)NS(=O)(=O)C3=CC=CS3

DOS

IR

Vibrations