Geometry & MOs

Info

ID:	171574
PubChem CID:	75396168
Reduced:	BrClNSO3H9C14 (1)
Stoich.:	ABCDE3F9G14 (1)
Weight, g/mol:	293.148789
ΔH_f, kcal/mol:	-46.46
Dipole, Da:	5.08
IP(EA), eV:	-9.78(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1,2,4-oxadiazol-3-yl)ethyl]-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C#N)OS(=O)(=O)CC2=C(C=C(C=C2)Cl)Br

DOS

IR

Vibrations