Geometry & MOs

Info

ID:	274275
PubChem CID:	103808189
Reduced:	OSN2C13H20 (1)
Stoich.:	ABC2D13E20 (1)
Weight, g/mol:	241.179027
ΔH_f, kcal/mol:	-25.85
Dipole, Da:	4.41
IP(EA), eV:	-9.11(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[1-oxo-1-(propylamino)propan-2-yl]piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CC1=CC=CS1)C(=O)[C@@H]2CCCCN2

DOS

IR

Vibrations