Geometry & MOs

Info

ID:	211793
PubChem CID:	81054194
Reduced:	OSN3C14H21 (1)
Stoich.:	ABC3D14E21 (1)
Weight, g/mol:	287.076219
ΔH_f, kcal/mol:	-24.43
Dipole, Da:	5.43
IP(EA), eV:	-8.53(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-(2-methylsulfonylethylamino)pyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=S)N)N(C)C2CCOCC2

DOS

IR

Vibrations