Geometry & MOs

Info

ID:	158449
PubChem CID:	56463668
Reduced:	N2S2O5C24H26 (1)
Stoich.:	A2B2C5D24E26 (1)
Weight, g/mol:	436.089342
ΔH_f, kcal/mol:	-138.16
Dipole, Da:	5.73
IP(EA), eV:	-9.02(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(2-ethylsulfonylethyl)-3-(3-methylpiperidin-1-yl)sulfonylbenzamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)CCNC(=O)C1=CC(=CC=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations