J
James Alexis Platts
Researcher at Cardiff University
Publications - 241
Citations - 7776
James Alexis Platts is an academic researcher from Cardiff University. The author has contributed to research in topics: Hydrogen bond & Density functional theory. The author has an hindex of 42, co-authored 231 publications receiving 7152 citations. Previous affiliations of James Alexis Platts include University of South Australia & Aarhus University.
Papers
More filters
Journal ArticleDOI
An experimental and theoretical charge density study of theophylline and malonic acid cocrystallization
Bryson A. Hawkins,Jonathan J. Du,Felcia Lai,Stephen A. Stanton,Peter A. Williams,Paul W. Groundwater,James Alexis Platts,Jacob Overgaard,David E. Hibbs +8 more
TL;DR: In this paper , the electron density distribution (EDD) changes between the cocrystal and its individual components were examined and a review of the EDD change associated with a chemical reaction was provided.
Journal ArticleDOI
Stereoelectronic control of photophysics: red and yellow axial and equatorial anomers of a rhenium-quinoline complex
TL;DR: A novel quinoline-substituted pyrimidine ligand forms two different coloured complexes upon reaction with Re(CO)5Br, showing distinct photophysical properties that are dictated by their stereochemistry.
Journal ArticleDOI
Synthesis and X-ray structure determination of thionated biphthalimides
TL;DR: In this article, X-ray crystallography showed that the achiral isomer of dithiodioxobiphthalimide, 1,3-dithioxo-1H-3H-[2,2']biisoindolyl-1 ',3'-dione is formed, which may imply a change in the mechanism of thiation between mono- and di-phthalimides.
Journal ArticleDOI
Quantum-Chemical Design of Cryptand-like Ditopic Salt Binders.
TL;DR: Hartree-Fock, density functional, and MP2 methods are applied to the problem of designing neutral, bicyclic C3-symmetric cages incorporating interacting anion- and cation-binding sites which strongly bind NaCl as an ion contact pair, suggesting that the binding cavity shape and size is near to the optimal one for this system.