Geometry & MOs

Info

ID:	329639
PubChem CID:	126920475
Reduced:	SO2N8C16H22 (1)
Stoich.:	AB2C8D16E22 (1)
Weight, g/mol:	282.134142
ΔH_f, kcal/mol:	56.01
Dipole, Da:	17.71
IP(EA), eV:	-9.04(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)C1=NC(=CN1C)S(=O)(=O)N(C)C2CN(C2)C3=NN4C=NN=C4C=C3

DOS

IR

Vibrations