Geometry & MOs

Info

ID:	337291
PubChem CID:	127256973
Reduced:	NOC9H17 (1)
Stoich.:	ABC9D17 (1)
Weight, g/mol:	215.152144
ΔH_f, kcal/mol:	-53.17
Dipole, Da:	2.56
IP(EA), eV:	-8.25(1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl 2-(3-hydroxypiperidin-3-yl)acetate

Drug info:

PubChemData

Smile

CC/C=C/N1CCCC(C1)O

DOS

IR

Vibrations