Results 31 to 40 of about 379,037 (236)

Halogen and Hydrogen Bonding in Halogenabenzene/NH₃ Complexes Compared Using Next-Generation QTAIM

Molecules, 2019
Next-generation quantum theory of atoms in molecules (QTAIM) was used to investigate the competition between hydrogen bonding and halogen bonding for the recently proposed (Y = Br, I, At)/halogenabenzene/NH3 complex. Differences between using the SR-ZORA
Shuman Li, Tianlv Xu, Tanja van Mourik, Herbert Früchtl, Steven R. Kirk, Samantha Jenkins   +5 more
doaj   +1 more source

Preorganization: A Powerful Tool in Intermolecular Halogen Bonding in Solution

ChemistryOpen, 2020
Preorganization is a powerful tool in supramolecular chemistry which has been utilized successfully in intra‐ and intermolecular halogen bonding. In previous work, we had developed a bidentate bis(iodobenzimidazolium)‐based halogen bond donor which ...
Martin H. H. Voelkel, Patrick Wonner, Prof. Dr. Stefan Matthias Huber   +2 more
doaj   +1 more source

Halogen bonding and chalcogen bonding mediated sensing [PDF]

, 2022
Sigma–hole interactions, in particular halogen bonding (XB) and chalcogen bonding (ChB), have become indispensable tools in supramolecular chemistry, with wide-ranging applications in crystal engineering, catalysis and materials chemistry as well as ...
Paul D., Beer, Hein, Robert, Robert, Hein, Beer, Paul D., Robert Hein, Paul D. Beer   +5 more
core   +2 more sources

Experimental and Theoretical Evidence for Nitrogen–Fluorine Halogen Bonding in Silver-Initiated Radical Fluorinations [PDF]

, 2019
We report experimental and computational evidence for nitrogen–fluorine halogen bonding in Ag(I)-initiated radical C–H fluorinations. Simple pyridines form [N–F–N]+ halogen bonds with Selectfluor to facilitate single-electron reduction by catalytic Ag(I).
Sarah, Baker, Ryan, Baxter, Alyssa, Hua, Hrant, Hratchian, Samantha, Bidwell   +4 more
core   +3 more sources

Promoting Halogen-Bonding Catalyzed Living Radical Polymerization through Ion-Pair Strain [PDF]

, 2022
Discovering efficient catalysts is highly desired in expanding the application of halogen-bonding catalysis. We herein report our findings on applying triaminocyclopropenium (TAC) iodides as highly potent catalysts for halogen-bonding catalyzed living ...
Yiliu, Liu, Xinjian, Su, Xiao-Gen, Xiong, Yanzhen, Wu, Shiwen, Huang   +4 more
core   +2 more sources

Mechanochemical Preparations of Anion Coordinated Architectures Based on 3‐Iodoethynylpyridine and 3‐Iodoethynylbenzoic Acid

ChemistryOpen, 2019
The halogen bond has previously been explored as a versatile tool in crystal engineering and anion coordination chemistry, with mechanochemical synthetic techniques having been shown to provide convenient routes towards cocrystals. In an effort to expand
Vincent M. Morin, Dr. Patrick M. J. Szell, Estelle Caron‐Poulin, Dr. Bulat Gabidullin, Prof. Dr. David L. Bryce   +4 more
doaj   +1 more source

π covalency in the halogen bond

Nature Communications, 2020
Current models of halogen bonding describe the σ-symmetric component of this interaction but do not contemplate the possibility of π-covalency. Here the authors provide experimental and computational evidence of π-covalency in halogen bonds involving ...
Cameron W. Kellett, Pierre Kennepohl, Curtis P. Berlinguette   +2 more
doaj   +1 more source

Supramolecular Halogen Bonds in Asymmetric Catalysis

Frontiers in Chemistry, 2020
Halogen bonding has received a significant increase in attention in the past 20 years. An important part of this interest has centered on catalytic applications of halogen bonding.
Mikk Kaasik, Tõnis Kanger
doaj   +1 more source

On the Importance of Halogen Bonding Interactions in Two X-ray Structures Containing All Four (F, Cl, Br, I) Halogen Atoms

Crystals, 2021
This manuscript reports the synthesis and X-ray characterization of two octahydro-1H-4,6-epoxycyclopenta[c]pyridin-1-one derivatives that contain the four most abundant halogen atoms (Ha) in the structure with the aim of studying the formation of Ha···Ha
Dmitriy F. Mertsalov, Rosa M. Gomila, Vladimir P. Zaytsev, Mikhail S. Grigoriev, Eugeniya V. Nikitina, Fedor I. Zubkov, Antonio Frontera   +6 more
doaj   +1 more source

Studies of Halogen Bonding Induced by Pentafluorosulfanyl Aryl Iodides: A Potential Group of Halogen Bond Donors in a Rational Drug Design

Molecules, 2019
The activation of halogen bonding by the substitution of the pentafluoro-λ6-sulfanyl (SF5) group was studied using a series of SF5-substituted iodobenzenes.
Yuji Sumii, Kenta Sasaki, Seiji Tsuzuki, Norio Shibata   +3 more
doaj   +1 more source