Geometry & MOs

Info

ID:	343661
PubChem CID:	127266837
Reduced:	SF3N3O3C13H14 (1)
Stoich.:	AB3C3D3E13F14 (1)
Weight, g/mol:	349.070797
ΔH_f, kcal/mol:	-191.73
Dipole, Da:	3.22
IP(EA), eV:	-9.97(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1S(=O)(=O)NC(C)C2=NOC(=N2)C(F)(F)F

DOS

IR

Vibrations