Geometry & MOs

Info

ID:	212575
PubChem CID:	81061058
Reduced:	N3C16H23 (1)
Stoich.:	A3B16C23 (1)
Weight, g/mol:	320.112939
ΔH_f, kcal/mol:	5.33
Dipole, Da:	5.42
IP(EA), eV:	-9.04(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-tert-butyl-1,3-thiazol-2-yl)amino]-2,6-dimethylpyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CCC1CCCC(C1)NC2=C(C(=NC(=C2)C)C)C#N

DOS

IR

Vibrations