Geometry & MOs

Info

ID:	122823
PubChem CID:	50823157
Reduced:	FSN3O3H16C21 (1)
Stoich.:	ABC3D3E16F21 (1)
Weight, g/mol:	451.120192
ΔH_f, kcal/mol:	-28.06
Dipole, Da:	6.64
IP(EA), eV:	-8.9(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[5-(3,5-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]phenyl]-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NOC(=N3)CC4=CC(=CC=C4)F

DOS

IR

Vibrations