Geometry & MOs

Info

ID:	329685
PubChem CID:	126920724
Reduced:	N4C7H8 (2)
Stoich.:	A4B7C8 (2)
Weight, g/mol:	301.110965
ΔH_f, kcal/mol:	158.46
Dipole, Da:	9.68
IP(EA), eV:	-9.15(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CN=C(N=C1)N(C)C2CN(C2)C3=NN4C=NN=C4C=C3

DOS

IR

Vibrations