Geometry & MOs

Info

ID:	159335
PubChem CID:	57269584
Reduced:	FO3C12H13 (1)
Stoich.:	AB3C12D13 (1)
Weight, g/mol:	230.139233
ΔH_f, kcal/mol:	-155.46
Dipole, Da:	4.16
IP(EA), eV:	-9.62(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-(1-acetyloxypiperidin-1-ium-1-yl)ethyl acetate

Drug info:

PubChemData

Smile

C1COC(O1)CC(=O)CC2=CC=C(C=C2)F

DOS

IR

Vibrations