Geometry & MOs

Info

ID:	70191
PubChem CID:	47211600
Reduced:	NOC8H12 (2)
Stoich.:	ABC8D12 (2)
Weight, g/mol:	277.179027
ΔH_f, kcal/mol:	-82.66
Dipole, Da:	5.16
IP(EA), eV:	-8.57(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3-methylpiperidin-1-yl)propyl]-1-oxidopyridin-1-ium-3-carboxamide

Drug info:

PubChemData

Smile

CC1CCCN(C1)CCCNC(=O)C2=CC=CC=C2O

DOS

IR

Vibrations