Geometry & MOs

Info

ID:	157417
PubChem CID:	56424091
Reduced:	ON2S3H16C18 (1)
Stoich.:	AB2C3D16E18 (1)
Weight, g/mol:	419.133734
ΔH_f, kcal/mol:	44.14
Dipole, Da:	4.01
IP(EA), eV:	-8.32(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[cyclohexyl(methyl)sulfamoyl]-N-(6-methylsulfanylpyridin-3-yl)benzamide

Drug info:

PubChemData

Smile

CSC1=NC=C(C=C1)NC(=O)C2=CC=CC=C2SCC3=CC=CS3

DOS

IR

Vibrations