Geometry & MOs

Info

ID:	68184
PubChem CID:	46507924
Reduced:	OSN3C11H11 (1)
Stoich.:	ABC3D11E11 (1)
Weight, g/mol:	233.062283
ΔH_f, kcal/mol:	50.56
Dipole, Da:	5.92
IP(EA), eV:	-8.94(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NOC(=N2)CC(=S)N

DOS

IR

Vibrations