Geometry & MOs

Info

ID:	212265
PubChem CID:	81059956
Reduced:	SN3C17H25 (1)
Stoich.:	AB3C17D25 (1)
Weight, g/mol:	291.176919
ΔH_f, kcal/mol:	1.63
Dipole, Da:	6.32
IP(EA), eV:	-8.46(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[cyclohexyl(ethyl)amino]-2,6-dimethylpyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=S)N)N2CCCC2C3CCCC3

DOS

IR

Vibrations