Geometry & MOs

Info

ID:	282326
PubChem CID:	103922352
Reduced:	OSN2C10H18 (1)
Stoich.:	ABC2D10E18 (1)
Weight, g/mol:	228.220164
ΔH_f, kcal/mol:	-37.92
Dipole, Da:	2.21
IP(EA), eV:	-9.17(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(1-tert-butylpiperidin-4-yl)amino]butan-1-ol

Drug info:

PubChemData

Smile

CC[C@H](CO)NC(C)C1=CN=C(S1)C

DOS

IR

Vibrations