Geometry & MOs

Info

ID:	122819
PubChem CID:	50823081
Reduced:	S2N4O5H20C22 (1)
Stoich.:	A2B4C5D20E22 (1)
Weight, g/mol:	421.109627
ΔH_f, kcal/mol:	-56.91
Dipole, Da:	8.24
IP(EA), eV:	-8.82(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NOC(=N3)CNS(=O)(=O)C4=CC=CC=C4

DOS

IR

Vibrations