Geometry & MOs

Info

ID:	211826
PubChem CID:	81054339
Reduced:	SN3C13H19 (1)
Stoich.:	AB3C13D19 (1)
Weight, g/mol:	277.161269
ΔH_f, kcal/mol:	38.43
Dipole, Da:	6.07
IP(EA), eV:	-8.5(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-ethylpiperidin-1-yl)-2,6-dimethylpyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=S)N)N(C)CC2CC2

DOS

IR

Vibrations