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From Molecules with a Planar Tetracoordinate Carbon to an Astronomically Known C(5)H(2) Carbene
[Image: see text] Ethynylcyclopropenylidene (2), an isomer of C(5)H(2), is a known molecule in the laboratory and has recently been identified in Taurus Molecular Cloud-1 (TMC-1). Using high-level coupled-cluster methods up to the CCSDT(Q)/CBS level of theory, it is shown that two isomers of C(5)H(2...
| 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/PMC9442649/ https://www.ncbi.nlm.nih.gov/pubmed/35426667 http://dx.doi.org/10.1021/acs.jpca.2c01261 |