Geometry & MOs

Info

ID:	157419
PubChem CID:	56424093
Reduced:	S2O3N4C19H20 (1)
Stoich.:	A2B3C4D19E20 (1)
Weight, g/mol:	318.086056
ΔH_f, kcal/mol:	-34.81
Dipole, Da:	9.17
IP(EA), eV:	-8.28(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,5-dimethylphenyl)sulfanyl-N-(6-methylsulfanylpyridin-3-yl)acetamide

Drug info:

PubChemData

Smile

CSC1=NC=C(C=C1)NC(=O)C2CCCN(C2)C3=NS(=O)(=O)C4=CC=CC=C43

DOS

IR

Vibrations