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Reversible Electron Transfer in the Formation of Radical Anionic and Dianionic 1,4-Diborabutatrienes

Lizhao Zhu, Chenyu Du, Yin Yang, Chunming Cui

2025Journal of the American Chemical Society6 citationsDOI

Abstract

One- and two-electron reductions of diborylacetylene 1 with potassium graphite (KC 8 ) yielded radical anionic and dianionic 1,4-diborabutatrienes 1 •– K + (thf) 2 and 1 2– (K + ) 2, respectively. X-ray diffraction, electron paramagnetic resonance, and computational studies indicated the π electron delocalization over the B–C–C–B cumulene skeleton. 1 2– (K + ) 2 possesses a relatively small HOMO–LUMO gap and exhibits a significantly red-shifted UV–vis absorption at λ max = 578 nm, compared to the all-carbon tetraarylbutatrienes. 1 2– (K + ) 2 could undergo a formal 1,4-addition with the C sp –H bond of phenylacetylene to produce 2, while the reaction with an organic azide led to the cleavage of B═C bonds with the formation of anionic iminoborane 3 . This work showcases a potential method for the facile construction of boracumulenes.

Topics & Concepts

ChemistryDelocalized electronCumuleneCyclooctatetraeneElectron transferPhotochemistryElectron paramagnetic resonanceCrystallographyPhenylacetyleneRadical ionBond cleavageAzideMoleculeIonOrganic chemistryNuclear magnetic resonanceCatalysisPhysicsOrganoboron and organosilicon chemistryRadical Photochemical ReactionsCatalytic Cross-Coupling Reactions
Reversible Electron Transfer in the Formation of Radical Anionic and Dianionic 1,4-Diborabutatrienes | Litcius