Geometry & MOs

Info

ID:	325510
PubChem CID:	126683701
Reduced:	SO4N6C25H26 (1)
Stoich.:	AB4C6D25E26 (1)
Weight, g/mol:	310.10659
ΔH_f, kcal/mol:	-5.33
Dipole, Da:	2.45
IP(EA), eV:	-8.24(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-dimethylimidazo[1,2-b][1,2,4]triazin-6-yl)-6-methoxy-1-benzofuran-4-ol

Drug info:

PubChemData

Smile

CC1CCN(CC1O)C2=NC(=CS2)COC3=CC(=CC4=C3C=C(O4)C5=CN6C(=N5)N=CC(=N6)C)OC

DOS

IR

Vibrations