Geometry & MOs

Info

ID:	212258
PubChem CID:	81059946
Reduced:	SO2N3C15H23 (1)
Stoich.:	AB2C3D15E23 (1)
Weight, g/mol:	306.187818
ΔH_f, kcal/mol:	-82.92
Dipole, Da:	5.44
IP(EA), eV:	-8.53(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=S)N)NC(CC(C)C)C(=O)OC

DOS

IR

Vibrations