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The halogen bond
The halogen bond occurs when there is evidence of a net attractive interaction between an
electrophilic region associated with a halogen atom in a molecular entity and a nucleophilic …
electrophilic region associated with a halogen atom in a molecular entity and a nucleophilic …
Relativistic heavy-neighbor-atom effects on NMR shifts: Concepts and trends across the periodic table
Chemical shifts present crucial information about an NMR spectrum. They show the
influence of the chemical environment on the nuclei being probed. Relativistic effects …
influence of the chemical environment on the nuclei being probed. Relativistic effects …
NMR crystallography of molecular organics
P Hodgkinson - Progress in Nuclear Magnetic Resonance …, 2020 - Elsevier
Developments of NMR methodology to characterise the structures of molecular organic
structures are reviewed, concentrating on the previous decade of research in which density …
structures are reviewed, concentrating on the previous decade of research in which density …
Unravelling the potential of sigma hole-assisted co-crystallization: Highlighting recent developments
In the past several decades, the field of cocrystal engineering has developed into a vital
research topic in supramolecular chemistry, holding the foremost scope in crystal …
research topic in supramolecular chemistry, holding the foremost scope in crystal …
Principles and Applications of CF2X Moieties as Unconventional Halogen Bond Donors in Medicinal Chemistry, Chemical Biology, and Drug Discovery
As an orthogonal principle to the established (hetero) aryl halides, we herein highlight the
usefulness of CF2X (X= Cl, Br, or I) moieties. Using tool compounds bearing CF2X moieties …
usefulness of CF2X (X= Cl, Br, or I) moieties. Using tool compounds bearing CF2X moieties …
Halogen bonding in the co-crystallization of potentially ditopic diiodotetrafluorobenzene: a powerful tool for constructing multicomponent supramolecular assemblies
Halogen bonding is emerging as a significant driving force for supramolecular self-assembly
and has aroused great interest during the last two decades. Among the various halogen …
and has aroused great interest during the last two decades. Among the various halogen …
[HTML][HTML] Relation between Halogen Bond Strength and IR and NMR Spectroscopic Markers
The relationship between the strength of a halogen bond (XB) and various IR and NMR
spectroscopic quantities is assessed through DFT calculations. Three different Lewis acids …
spectroscopic quantities is assessed through DFT calculations. Three different Lewis acids …
Solid-state NMR spectroscopy for the analysis of element-based non-covalent interactions
We review applications of solid-state NMR spectroscopy for the analysis of element-based
non-covalent interactions, with an emphasis on developments since 2009. The review is …
non-covalent interactions, with an emphasis on developments since 2009. The review is …
Halogen‐Bond Effects on the Thermo‐and Photochromic Behaviour of Anil‐Based Molecular Co‐crystals
A Carletta, F Spinelli, S d'Agostino… - … A European Journal, 2017 - Wiley Online Library
N‐Salicilideneanilines are among the most studied thermo‐and photochromic systems in
the solid state. Although thermochromism is a general property of crystalline N …
the solid state. Although thermochromism is a general property of crystalline N …
Stabilizing volatile liquid chemicals using co-crystallization
CB Aakeröy, TK Wijethunga, J Benton… - Chemical …, 2015 - pubs.rsc.org
A convenient, effective, and scalable protocol for stabilizing volatile liquid chemicals is
reported. Through the use of halogen-bond driven co-crystal synthesis, several examples of …
reported. Through the use of halogen-bond driven co-crystal synthesis, several examples of …