Cyclobutadiene nickel complex as a catalyst for CH-activation reactions: computational study was written by Ankudinov, Nikita M.;Perekalin, Dmitry S.. And the article was included in Mendeleev Communications in 2019.Computed Properties of C9H7NO This article mentions the following:
DFT calculations suggest that, similarly to the classical [CpRhCl2]2 catalyst, the isolobal cyclobutadiene Ni complex [(C4Me4)NiCl2]2 can promote CH-activation of arenes (activation barrier is ∼30 kcal mol-1). In the experiment, the researchers used many compounds, for example, 1-Hydroxyisoquinoline (cas: 491-30-5Computed Properties of C9H7NO).
1-Hydroxyisoquinoline (cas: 491-30-5) belongs to isoquinoline derivatives. The isoquinoline structure occurs in a considerable number of alkaloids in widely separated plant families. Other industrial applications include their use as corrosion inhibitors, preservatives, and as solvents for resins and terpenes.Computed Properties of C9H7NO
Referemce:
Isoquinoline – Wikipedia,
Isoquinoline | C9H7N – PubChem