Geometry & MOs

Info

ID:	343649
PubChem CID:	127266825
Reduced:	NSO3C13H17 (1)
Stoich.:	ABC3D13E17 (1)
Weight, g/mol:	349.070797
ΔH_f, kcal/mol:	-89.61
Dipole, Da:	3.85
IP(EA), eV:	-9.71(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methylphenyl)-N-[1-[3-(trifluoromethyl)-1,2,4-oxadiazol-5-yl]ethyl]methanesulfonamide

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1S(=O)(=O)NC2(CC2)C(=O)C

DOS

IR

Vibrations