Geometry & MOs

Info

ID:	36533
PubChem CID:	8008065
Reduced:	ClN2O3C19H21 (1)
Stoich.:	AB2C3D19E21 (1)
Weight, g/mol:	373.168281
ΔH_f, kcal/mol:	-101.97
Dipole, Da:	4.86
IP(EA), eV:	-8.71(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(2R)-N-(3-chloro-4-methoxyphenyl)-2-[(3R)-3-methylpiperidin-1-ium-1-yl]-2-phenylacetamide

Drug info:

PubChemData

Smile

CC(C)N(CC1=CC=CC=C1)C(=O)COC(=O)C2=C(C=CC(=C2)Cl)N

DOS

IR

Vibrations