Reprint

Synthesis, Crystal Structures and Hirshfeld Surface Analysis of Coordination Compounds (Volume II)

Edited by
June 2023
220 pages
  • ISBN978-3-0365-7928-3 (Hardback)
  • ISBN978-3-0365-7929-0 (PDF)

This is a Reprint of the Special Issue Synthesis, Crystal Structures and Hirshfeld Surface Analysis of Coordination Compounds (Volume II) that was published in

Chemistry & Materials Science
Engineering
Environmental & Earth Sciences
Summary

The special issue of  Crystals entitled “Synthesis, Crystal Structures and Hirshfeld Surface Analysis of Coordination Compounds” (Volume II) resulted in the publication of 13 articles. The chemistry of coordination compounds plays a vital role in various areas of science, including inorganic chemistry, biochemistry, catalysis, materials science, and medicine. The main goal of this edition was the synthesis of new complex compounds with interesting properties. In order to achieve this goal, it was important to know the crystal structure and intermolecular interactions described by Hirshfeld surfaces. The crystal structure analysis plays a crucial role in predicting and correlating material properties and designing new materials. Whereas the Hirshfeld analysis provides valuable insights into the interactions between atoms in a crystal structure. It can be used to quantify and visualize intermolecular contacts, hydrogen bonding patterns, and other types of non-covalent interactions. Additionally, it can also help understand the effects of crystal packing on molecular properties, such as charge transfer, electrostatic interactions, and deformation of electron density. Overall, the chemistry of coordination compounds provides a rich framework for understanding and manipulating the properties and behavior of various substances. Its significance spans across different scientific disciplines, contributing to advancements in technology, medicine, and our understanding of the natural world. I hope, that readers will find interesting articles in this special issue of Crystals.

Format
  • Hardback
License and Copyright
© 2022 by the authors; CC BY-NC-ND license
Keywords
crystal structure; alkali salts; surface analysis; ionic liquids; crystal structure; Hirshfeld surfaces; α-glucosidase inhibition; molecular docking simulation; molecular dynamics simulations; binding free energy calculations; copper (II) complex; synthesis; HIV-1 protease enzyme inhibitor; crystal structure; non-covalent interactions; Hirshfeld surface; molecular docking; Citrulline; copper; DFT calculations; Hirshfeld surface analysis; non-covalent interactions; magnesium; formate; acetate; propionate; hexamethylenetetramine; crystal structure; thermal analysis; infrared spectroscopy; hydrogen bonds; organotin(IV) compounds; NMR spectroscopy; crystal structure; cyclic dimeric; noncovalent interactions; antibacterial activity; polymorphism; Hirshfeld analysis; DFT calculations; trinuclear copper; pyrazolato ligands; co-crystal hydrate; supramolecular assemblies; enclathration; cooperative π-stacking; DFT calculations; transition metals; synthesis; crystal structure; non-covalent interactions; Hirshfeld surface; crystal structure; organic–inorganic hybrid; lead(II) perovskite; Schiff-base ligand; Hirshfeld surface analysis; QTAIM analysis; DFT calculations; reflectance spectra; band gap; crystal structure; phenanthroline ligand; supramolecular interactions; π-stacking; Hirshfeld surface analysis; IR and Raman spectroscopy; self-assembly; DFT calculations; hydrogen bonding; noncovalent interactions; X-ray structure; rhenium(II); triazole; pyrazole; imidazole; tetrazole; magnetic properties; thallium; indium; main group chemistry; tripodal ligand; thiol ligand; crystal structure; hydrogen bonding; Hirshfeld surface analysis

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