Geometry & MOs

Info

ID:	212540
PubChem CID:	81060890
Reduced:	SO2N3C15H21 (1)
Stoich.:	AB2C3D15E21 (1)
Weight, g/mol:	277.161269
ΔH_f, kcal/mol:	-71.38
Dipole, Da:	5.25
IP(EA), eV:	-8.6(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC(=O)C1CCCN1C2=C(C(=NC(=C2)C)C)C(=S)N

DOS

IR

Vibrations