Geometry & MOs

Info

ID:	208276
PubChem CID:	80510735
Reduced:	ON4C13H20 (1)
Stoich.:	AB4C13D20 (1)
Weight, g/mol:	194.062618
ΔH_f, kcal/mol:	20.81
Dipole, Da:	1.57
IP(EA), eV:	-9.07(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(cyclopropylamino)pyridazine-4-carbothioamide

Drug info:

PubChemData

Smile

CCC1=C(N=NC(=C1C#N)OCCN(C)C)CC

DOS

IR

Vibrations