Literature DB >> 22011957

Symmetry of [N-X-N]+ halogen bonds in solution.

Anna-Carin C Carlsson1, Jürgen Gräfenstein, Jesse L Laurila, Jonas Bergquist, Máté Erdélyi.   

Abstract

The first investigation of halogen bond symmetry is presented. In contrast to related hydrogen bonds, the iodous halogen bond is symmetric in solution and in the crystal. The bromous analogue is symmetric in solution, but shows asymmetry in the solid state. NMR results are in agreement with DFT predictions. This journal is © The Royal Society of Chemistry 2012

Entities:  

Year:  2011        PMID： 22011957     DOI： 10.1039/c1cc15839b

Source DB:  PubMed          Journal:  Chem Commun (Camb)        ISSN： 1359-7345            Impact factor:   6.222


  8 in total

1.  Symmetry of three-center, four-electron bonds.

Authors:  Ann Christin Reiersølmoen; Stefano Battaglia; Sigurd Øien-Ødegaard; Arvind Kumar Gupta; Anne Fiksdahl; Roland Lindh; Máté Erdélyi
Journal:  Chem Sci       Date:  2020-06-30       Impact factor: 9.825

2.  The Structure of the "Vibration Hole" around an Isotopic Substitution-Implications for the Calculation of Nuclear Magnetic Resonance (NMR) Isotopic Shifts.

Authors:  Jürgen Gräfenstein
Journal:  Molecules       Date:  2020-06-24       Impact factor: 4.411

3.  Halogen Bond Asymmetry in Solution.

Authors:  Sofia Lindblad; Krenare Mehmeti; Alberte X Veiga; Bijan Nekoueishahraki; Jürgen Gräfenstein; Máté Erdélyi
Journal:  J Am Chem Soc       Date:  2018-10-04       Impact factor: 15.419

4.  Halogen Bond of Halonium Ions: Benchmarking DFT Methods for the Description of NMR Chemical Shifts.

Authors:  Daniel Sethio; Gerardo Raggi; Roland Lindh; Máté Erdélyi
Journal:  J Chem Theory Comput       Date:  2020-11-02       Impact factor: 6.006

Review 5.  The Halogen Bond.

Authors:  Gabriella Cavallo; Pierangelo Metrangolo; Roberto Milani; Tullio Pilati; Arri Priimagi; Giuseppe Resnati; Giancarlo Terraneo
Journal:  Chem Rev       Date:  2016-01-26       Impact factor: 60.622

6.  Substituent Effects on the [N-I-N](+) Halogen Bond.

Authors:  Anna-Carin C Carlsson; Krenare Mehmeti; Martin Uhrbom; Alavi Karim; Michele Bedin; Rakesh Puttreddy; Roland Kleinmaier; Alexei A Neverov; Bijan Nekoueishahraki; Jürgen Gräfenstein; Kari Rissanen; Máté Erdélyi
Journal:  J Am Chem Soc       Date:  2016-06-17       Impact factor: 15.419

7.  Counterion influence on the N-I-N halogen bond.

Authors:  Michele Bedin; Alavi Karim; Marcus Reitti; Anna-Carin C Carlsson; Filip Topić; Mario Cetina; Fangfang Pan; Vaclav Havel; Fatima Al-Ameri; Vladimir Sindelar; Kari Rissanen; Jürgen Gräfenstein; Máté Erdélyi
Journal:  Chem Sci       Date:  2015-04-20       Impact factor: 9.825

8.  Are bis(pyridine)iodine(I) complexes applicable for asymmetric halogenation?

Authors:  Daniel von der Heiden; Flóra Boróka Németh; Måns Andreasson; Daniel Sethio; Imre Pápai; Mate Erdelyi
Journal:  Org Biomol Chem       Date:  2021-10-06       Impact factor: 3.876
  8 in total

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