Geometry & MOs

Info

ID:	157414
PubChem CID:	56424071
Reduced:	S2N3O3C19H23 (1)
Stoich.:	A2B3C3D19E23 (1)
Weight, g/mol:	419.133734
ΔH_f, kcal/mol:	-70.92
Dipole, Da:	2.46
IP(EA), eV:	-8.36(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(6-methylsulfanylpyridin-3-yl)benzamide

Drug info:

PubChemData

Smile

CSC1=NC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

DOS

IR

Vibrations