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Carbene Routes to Cyclopropatetrahedrane
[Image: see text] The formation of cyclopropatetrahedrane (tetracyclo[2.1.0.0(1,3).0(2,4)]pentane) via four different carbene reactions is computed using the (U)CCSD(T)(full)/cc-pVTZ//(U)ωB97X-D/cc-pVTZ + 1.3686(E(ZPVE)) theoretical model. Intrinsic reaction coordinate plots confirm that each carben...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2022
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9764353/ https://www.ncbi.nlm.nih.gov/pubmed/36446051 http://dx.doi.org/10.1021/acs.joc.2c02217 |