Geometry & MOs

Info

ID:	174773
PubChem CID:	75812804
Reduced:	ON2F3C18H25 (1)
Stoich.:	AB2C3D18E25 (1)
Weight, g/mol:	363.264768
ΔH_f, kcal/mol:	-209.27
Dipole, Da:	2.18
IP(EA), eV:	-8.51(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

3,4-diethoxy-N-[4-(3-methylpiperidin-1-ium-1-yl)butyl]benzamide

Drug info:

PubChemData

Smile

CC1CCCN(C1)CCCNC(=O)CC2=CC(=CC=C2)C(F)(F)F

DOS

IR

Vibrations