Geometry & MOs

Info

ID:	137785
PubChem CID:	52262021
Reduced:	N2O3C16H24 (1)
Stoich.:	A2B3C16D24 (1)
Weight, g/mol:	388.146166
ΔH_f, kcal/mol:	-116.49
Dipole, Da:	4.5
IP(EA), eV:	-9.27(0.0)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(1R)-1-(2-chlorophenyl)-2-[[(2S)-1-methylsulfonylpiperidine-2-carbonyl]amino]ethyl]-dimethylazanium

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CN(C)C(=O)C1=CC=CC=C1COC

DOS

IR

Vibrations