On the aromaticity of square planar Ga-4(2-) and In-4(2-) in gaseous NaGa4- and NaIn4- clusters
Abstract
We investigated the electronic structure and chemical bonding of two bimetallic clusters NaGa4- and NaIn4-. Photoelectron spectra of the anions were obtained and compared with ab initio calculations. We found that the ground state of the two anions contains a square planar dianion interacting with a Na+ cation. The Ga-4(2-) and In-4(2-) dianions both possess two delocalized pi electrons and are considered to be aromatic, similar to that recently found in Al-4(2-). Using calculations for a model compound, we showed that a recently synthesized Ga-4-organometallic compound also contains an aromatic -Ga-4(2-)- unit, analogous to the gaseous clusters.
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| Título según WOS: | ID WOS:000170925400022 Not found in local WOS DB |
| Título de la Revista: | JOURNAL OF THE AMERICAN CHEMICAL SOCIETY |
| Volumen: | 123 |
| Número: | 36 |
| Editorial: | AMER CHEMICAL SOC |
| Fecha de publicación: | 2001 |
| Página de inicio: | 8825 |
| Página final: | 8831 |
| DOI: |
10.1021/ja0106117 |
| Notas: | ISI |