Geometry & MOs

Info

ID:	274431
PubChem CID:	103809319
Reduced:	NOC6H12 (2)
Stoich.:	ABC6D12 (2)
Weight, g/mol:	228.183778
ΔH_f, kcal/mol:	-116.38
Dipole, Da:	2.64
IP(EA), eV:	-9.07(1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-1-(3-methoxypiperidin-1-yl)-4-methylpentan-1-one

Drug info:

PubChemData

Smile

CCCC(C)(C(=O)N1CCCC(C1)OC)N

DOS

IR

Vibrations