Geometry & MOs

Info

ID:	61009
PubChem CID:	26704205
Reduced:	ON2S2F3H7C13 (1)
Stoich.:	AB2C2D3E7F13 (1)
Weight, g/mol:	358.029125
ΔH_f, kcal/mol:	-110.06
Dipole, Da:	6.9
IP(EA), eV:	-9.69(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(3-cyanothiophen-2-yl)propanamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)NC2=C(C=CS2)C#N)SC(F)(F)F

DOS

IR

Vibrations