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Ab initio calculations find 2,2-disilylcyclopentane-1,3-diyl is a singlet diradical with a high barrier to ring closure

William T. G. Johnson, David A. Hrovat, Anne Skancke, Weston Thatcher Borden

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Key concepts: Diradical, Singlet state, Singlet fission, Ab initio, Ring (chemistry), Chemistry, Triplet state, Computational chemistry

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Ab initio calculations find 2,2-disilylcyclopentane-1,3-diyl is a singlet diradical with a high barrier to ring closure — Research Paper | ScholarLens