Geometry & MOs

Info

ID:	212251
PubChem CID:	81059935
Reduced:	ON2C14H20 (1)
Stoich.:	AB2C14D20 (1)
Weight, g/mol:	320.112939
ΔH_f, kcal/mol:	-24.2
Dipole, Da:	5.29
IP(EA), eV:	-9.83(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethylamino]-2,6-dimethylpyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CCCCCCOC1=C(C(=NC(=C1)C)C)C#N

DOS

IR

Vibrations