Geometry & MOs

Info

ID:	329663
PubChem CID:	126920555
Reduced:	ON4C7H8 (2)
Stoich.:	AB4C7D8 (2)
Weight, g/mol:	296.149793
ΔH_f, kcal/mol:	49.84
Dipole, Da:	8.59
IP(EA), eV:	-9.74(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,6-dimethyl-N-[1-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)azetidin-3-yl]pyrazin-2-amine

Drug info:

PubChemData

Smile

CN1C(=O)C=C(NC1=O)N(C)C2CN(C2)C3=NN4C=NN=C4C=C3

DOS

IR

Vibrations