The interplay between hydrogen and halogen bonding: substituent effects and their role in the hydrogen bond enhanced halogen bond
Year: 2023
Type: article
Abstract: The hydrogen bond enhanced halogen bond can be modulated by changing substituents on the HB or XB donor ring. Thus, distant substituents can impact nearby noncovalent interactions and this can be used as a viable approach for molecular design.
Source: Chemical Science
DOI: 10.1039/d3sc02348f
Institutions: University of Montana, Oak Ridge National Laboratory
Language: English
Subfield: Physical and Theoretical Chemistry
Field: Chemistry
Domain: Physical Sciences
Open Access status: diamond
Funders: National Science Foundation, U.S. Department of Energy, University of Montana, Montana University System, National Energy Research Scientific Computing Center, National Institutes of Health, Office of Science, National Institute of General Medical Sciences, Division of Chemistry, Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division, Oak Ridge National Laboratory
Awards: G1019100964, G121915436, G122673668, G1286236842, G1286251239, G1310521215, G1401875832, G1414775356, G1528409558, G1645119126, G1677143136, G1863003419, G189715294, G1942859959, G203625172, G2037563265, G2411683797, G2523737452, G2539837713, G2584197162, G2988778103, G30714459, G3083819904, G354619025, G365575497, G382641700, G3826466080, G419881185, G42916606, G4423657506, G4501827968, Fundamental Studies of the Hydrogen Bond Enhanced Halogen Bond (HBeXB) for Molecular Folding and Anion Transport, G498139845, G5076365615, G5094606986, G5849692847, G650090426, MRI: Acquisition of a Small Molecule Single Crystal X-ray Diffractometer for Research and Education Across Montana, G660579501, G675320460, G6776491064, G6911681599, G7651947074, G7734004253, G7985845699, G807938293, G8083213725, G8269158468, G8906985441, Biomolecular Structure and Dynamics, G969889393
OpenAlex ID: W4385154107