Geometry & MOs

Info

ID:	68183
PubChem CID:	46507921
Reduced:	OSF3N3H8C11 (1)
Stoich.:	ABC3D3E8F11 (1)
Weight, g/mol:	233.062283
ΔH_f, kcal/mol:	-100.85
Dipole, Da:	3.04
IP(EA), eV:	-9.07(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethanethioamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)C(F)(F)F)C2=NOC(=N2)CC(=S)N

DOS

IR

Vibrations