Geometry & MOs

Info

ID:	208278
PubChem CID:	80511436
Reduced:	OSN5C14H23 (1)
Stoich.:	ABC5D14E23 (1)
Weight, g/mol:	262.100066
ΔH_f, kcal/mol:	-10.1
Dipole, Da:	4.45
IP(EA), eV:	-8.59(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[methyl-[(1-methylimidazol-2-yl)methyl]amino]pyridazine-4-carbothioamide

Drug info:

PubChemData

Smile

CCC1=C(N=NC(=C1C(=S)N)N(C)CC(=O)NCC)CC

DOS

IR

Vibrations