Geometry & MOs

Info

ID:	343097
PubChem CID:	127266270
Reduced:	ON4C17H26 (1)
Stoich.:	AB4C17D26 (1)
Weight, g/mol:	276.183778
ΔH_f, kcal/mol:	13.81
Dipole, Da:	3.55
IP(EA), eV:	-8.73(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-[(2-methoxyphenyl)methylamino]propyl]piperidin-2-one

Drug info:

PubChemData

Smile

CC(C)(CN1CCOCC1)CN(C)CC2=NC(=CC=C2)C#N

DOS

IR

Vibrations