Geometry & MOs

Info

ID:	346914
PubChem CID:	127271418
Reduced:	O2N5C18H23 (1)
Stoich.:	A2B5C18D23 (1)
Weight, g/mol:	398.243024
ΔH_f, kcal/mol:	9.16
Dipole, Da:	3.88
IP(EA), eV:	-9.04(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-ethylpiperidin-4-yl)-2-[4-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]acetamide

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)CN2CCC(CC2)C3=NC(=NO3)C4=CC=CC=N4

DOS

IR

Vibrations