Geometry & MOs

Info

ID:	158607
PubChem CID:	56464308
Reduced:	N2S2O5C17H26 (1)
Stoich.:	A2B2C5D17E26 (1)
Weight, g/mol:	416.143964
ΔH_f, kcal/mol:	-208.82
Dipole, Da:	5.45
IP(EA), eV:	-9.65(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethylsulfonylethyl)-2-methyl-5-(2-methylpiperidin-1-yl)sulfonylbenzamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)CCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)C

DOS

IR

Vibrations