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Anion Recognition by Neutral and Cationic Iodotriazole Halogen Bonding Scaffolds

A computational study of the iodide discrimination by different neutral and cationic iodotriazole halogen bonding hosts was carried out by means of Density Functional Theory. The importance of the size of the scaffold was highlighted and its impact observed in the binding energies and intermolecular...

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Detaylı Bibliyografya
Yayımlandı:Molecules
Asıl Yazarlar: Iribarren, Iñigo, Sánchez-Sanz, Goar, Trujillo, Cristina
Materyal Türü: Artigo
Dil:Inglês
Baskı/Yayın Bilgisi: MDPI 2020
Konular:
Online Erişim:https://ncbi.nlm.nih.gov/pmc/articles/PMC7070532/
https://ncbi.nlm.nih.gov/pubmed/32059506
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules25040798
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