Geometry & MOs

Info

ID:	208279
PubChem CID:	80511501
Reduced:	SN6C11H14 (1)
Stoich.:	AB6C11D14 (1)
Weight, g/mol:	259.089167
ΔH_f, kcal/mol:	105.98
Dipole, Da:	4.6
IP(EA), eV:	-8.68(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(6-methylpyridin-3-yl)methylamino]pyridazine-4-carbothioamide

Drug info:

PubChemData

Smile

CN1C=CN=C1CN(C)C2=C(C=CN=N2)C(=S)N

DOS

IR

Vibrations