Geometry & MOs

Info

ID:	370416
PubChem CID:	127338547
Reduced:	O2N3C21H25 (1)
Stoich.:	A2B3C21D25 (1)
Weight, g/mol:	300.158626
ΔH_f, kcal/mol:	-22.36
Dipole, Da:	6.05
IP(EA), eV:	-9.63(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(1,2,4-oxadiazol-3-yl)piperidin-1-yl]-3-pyridin-3-ylbutan-1-one

Drug info:

PubChemData

Smile

CC1=NN=C(O1)C2CC3=CC=CC=C3CN2C(=O)CC4CC5CCC4C5

DOS

IR

Vibrations