Geometry & MOs

Info

ID:	211828
PubChem CID:	81054342
Reduced:	SN3C14H23 (1)
Stoich.:	AB3C14D23 (1)
Weight, g/mol:	306.097289
ΔH_f, kcal/mol:	-10.37
Dipole, Da:	4.3
IP(EA), eV:	-8.52(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-[1-(1,3-thiazol-2-yl)propylamino]pyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CCC(C)C(C)NC1=C(C(=NC(=C1)C)C)C(=S)N

DOS

IR

Vibrations