Geometry & MOs

Info

ID:	211845
PubChem CID:	81054415
Reduced:	SN3C15H23 (1)
Stoich.:	AB3C15D23 (1)
Weight, g/mol:	279.176919
ΔH_f, kcal/mol:	26.98
Dipole, Da:	6.11
IP(EA), eV:	-8.44(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3,3-dimethylbutan-2-yl(methyl)amino]-2,6-dimethylpyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=S)N)N(CC(C)C)C2CC2

DOS

IR

Vibrations