Geometry & MOs

Info

ID:	140597
PubChem CID:	52728670
Reduced:	SN2O4C18H22 (1)
Stoich.:	AB2C4D18E22 (1)
Weight, g/mol:	371.233468
ΔH_f, kcal/mol:	-119.75
Dipole, Da:	6.85
IP(EA), eV:	-8.85(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-(4-ethoxypiperidin-1-ium-1-yl)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylacetamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1OC[C@H](CN2CCC3=C2C=CC(=C3)S(=O)(=O)N)O

DOS

IR

Vibrations