Geometry & MOs

Info

ID:	207553
PubChem CID:	80414009
Reduced:	OSN3C14H19 (1)
Stoich.:	ABC3D14E19 (1)
Weight, g/mol:	257.098669
ΔH_f, kcal/mol:	3.45
Dipole, Da:	6.02
IP(EA), eV:	-8.86(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl-(6-methylpyridin-2-yl)amino]benzenecarbothioamide

Drug info:

PubChemData

Smile

CN(CCC(=O)NC1CC1)C2=CC=CC=C2C(=S)N

DOS

IR

Vibrations