Geometry & MOs

Info

ID:	211809
PubChem CID:	81054270
Reduced:	OSN3C15H19 (1)
Stoich.:	ABC3D15E19 (1)
Weight, g/mol:	289.136117
ΔH_f, kcal/mol:	14.66
Dipole, Da:	4.66
IP(EA), eV:	-8.54(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridine-3-carbothioamide

Drug info:

PubChemData

Smile

CCN(CC1=CC=CO1)C2=C(C(=NC(=C2)C)C)C(=S)N

DOS

IR

Vibrations