Geometry & MOs

Info

ID:	157766
PubChem CID:	56437088
Reduced:	SN4O4C19H22 (1)
Stoich.:	AB4C4D19E22 (1)
Weight, g/mol:	458.162391
ΔH_f, kcal/mol:	-57.15
Dipole, Da:	6.36
IP(EA), eV:	-8.59(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[benzyl(methyl)sulfamoyl]-4-methoxy-N-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]benzamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCCNC(=O)CC2=CSC(=N2)C3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations