Geometry & MOs

Info

ID:	274817
PubChem CID:	103811837
Reduced:	ON2C14H24 (1)
Stoich.:	AB2C14D24 (1)
Weight, g/mol:	214.168128
ΔH_f, kcal/mol:	-20.77
Dipole, Da:	4.87
IP(EA), eV:	-9.16(1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(3-hydroxybutyl)-N-methylpiperidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCN[C@@H](C1)C(=O)N(CC2CC2)CC3CC3

DOS

IR

Vibrations