Geometry & MOs

Info

ID:	158839
PubChem CID:	56479543
Reduced:	BrSN3O3C19H24 (1)
Stoich.:	ABC3D3E19F24 (1)
Weight, g/mol:	499.181078
ΔH_f, kcal/mol:	-98.93
Dipole, Da:	6.88
IP(EA), eV:	-8.65(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxo-4-piperidin-1-ylthiolan-3-yl)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=C1C(=O)NC3CS(=O)(=O)CC3N4CCCCC4)Br

DOS

IR

Vibrations