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- W4387114562 abstract "Photolysis of 1-(2-adamantylidene)-1a,9b-dihydro-1H-cyclopropa[l]phenanthrene in benzene (or benzene-d6) at ambient temperature produces adamantylidenecarbene. The carbene undergoes dimerization to a cumulene and may also be trapped in a stereospecific fashion by cis- and trans-4-methyl-2-pentene. No products attributable to 4-homoadamantyne, resulting from ring expansion of the carbene, could be detected. Coupled cluster/density functional theory calculations place the singlet carbene ∼49 kcal/mol below the triplet and show that the former must overcome a barrier of ∼13.5 kcal/mol to rearrange into 4-homoadamantyne." @default.
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- W4387114562 date "2023-09-28" @default.
- W4387114562 modified "2023-10-17" @default.
- W4387114562 title "Adamantylidenecarbene: Photochemical Generation, Trapping, and Theoretical Studies" @default.
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- W4387114562 doi "https://doi.org/10.1021/acs.joc.3c01399" @default.
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