Geometry & MOs

Info

ID:	365636
PubChem CID:	127318357
Reduced:	O3N4C18H22 (1)
Stoich.:	A3B4C18D22 (1)
Weight, g/mol:	338.149124
ΔH_f, kcal/mol:	-42.21
Dipole, Da:	3.06
IP(EA), eV:	-8.88(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-[6-(3,5-dimethylpyrazol-1-yl)pyridin-3-yl]-1,2,4-oxadiazol-5-yl]piperidin-2-one

Drug info:

PubChemData

Smile

C1CC(=O)NCC1C2=NC(=NO2)C3=CC=CC(=C3)CN4CCOCC4

DOS

IR

Vibrations