Geometry & MOs

Info

ID:	137253
PubChem CID:	52177308
Reduced:	NC8H17 (1)
Stoich.:	AB8C17 (1)
Weight, g/mol:	182.129337
ΔH_f, kcal/mol:	-31.5
Dipole, Da:	1.83
IP(EA), eV:	-8.82(3.28)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

5-methyl-3-(piperidin-1-ium-4-ylmethyl)-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC(C)[C@@H]1CCCNC1

DOS

IR

Vibrations