Geometry & MOs

Info

ID:	136917
PubChem CID:	52122273
Reduced:	O2N6C23H34 (1)
Stoich.:	A2B6C23D34 (1)
Weight, g/mol:	392.196074
ΔH_f, kcal/mol:	-20.5
Dipole, Da:	1.26
IP(EA), eV:	-8.37(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-pyridin-3-ylethyl)-1-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)CCNC(=O)C2CCN(CC2)CC3=NN=C(O3)C4=CC=CC=C4

DOS

IR

Vibrations