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Title: | Halogen bonding (HaB) in E-I⋯X-M systems: Influence of the halogen donor on the HaB nature |
Authors: | Dortez, Silvia; Fernández-Palacio, F.; Damián, J.; Gaiteiro, C.; Ramos, Javier CSIC ORCID ; Gómez-Sal, Pilar; Mosquera, Marta E.G. | Issue Date: | 19-Nov-2019 | Publisher: | Royal Society of Chemistry (UK) | Citation: | CrystEngComm 22: 870-877 (2020) | Abstract: | New halogen bonded networks containing the organometallic complexes [Ru(CNBu)(X)] (X = Cl, Br, I) have been prepared. Two different types of halogen donors have been explored, I and ICFI, to study the influence of the halogen bond donor on the parameters and the nature of the interaction. We have performed a combined experimental and theoretical study. In the results, the species with ICFI as a halogen bond donor show weaker interactions, as evidenced by the geometrical parameters and by the DFT calculations. In fact, it was not possible to isolate the HaB network containing the complex [Ru(CNBu)(I)] and ICFI. Furthermore, the studies show that the interaction for iodine has a higher covalent component than that for ICFI. | Description: | 8 pags., 3 figs., 5 tabs. -- This article is part of the themed collections: Supramolecular & Polymorphism and 1st International Conference on Noncovalent Interactions | Publisher version (URL): | http://dx.doi.org/10.1039/c9ce01449g | URI: | http://hdl.handle.net/10261/231161 | DOI: | 10.1039/c9ce01449g | Identifiers: | doi: 10.1039/c9ce01449g issn: 1466-8033 |
Appears in Collections: | (CFMAC-IEM) Artículos |
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Halogen Bonding.pdf | 1,63 MB | Adobe PDF | ![]() View/Open | |
Supplementary material.pdf | 1,36 MB | Adobe PDF | ![]() View/Open |
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