Geometry & MOs

Info

ID:	138733
PubChem CID:	52417168
Reduced:	ON6C15H18 (1)
Stoich.:	AB6C15D18 (1)
Weight, g/mol:	281.166531
ΔH_f, kcal/mol:	78.87
Dipole, Da:	6.9
IP(EA), eV:	-8.81(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N-(2-fluorophenyl)-2-[(3R)-3-(methoxymethyl)piperidin-1-ium-1-yl]acetamide

Drug info:

PubChemData

Smile

CCOCCCNC1=C2C=NN(C2=NN=N1)C3=CC=CC=C3

DOS

IR

Vibrations