The dichromium Pacman complex (dmx)CrCl·CHO (1) [(dmx)H is a dimethylxanthene-bridged cofacial (bis)dipyrrin, CHNO] was synthesized by salt metathesis using anhydrous CrCl and previously reported (dmx)K. Treatment of 1 with two equivalents of the reductant potassium graphite afforded K(dmx)CrCl(thf)·0.5CHO·0.5CHO (thf is tetrahydrofuran, CHO) (2), with both potassium ions intercalated between the pyrrolic subunits. Comparison of the solid-state structures for 1 and 2 reveals minimal changes in the primary coordination sphere of each Cr ion, with notable elongation of the dipyrrin C-C and C-N bonds upon reduction, consistent with computational support for a ligand-based reduction.
Download full-text PDF |
Source |
---|---|
http://dx.doi.org/10.1107/S2053229621001388 | DOI Listing |
Langmuir
December 2024
Key Laboratory of Functional Polymer Materials of Ministry of Education and College of Chemistry, Nankai University, Tianjin 300071, China.
Polyelectrolyte complex (PEC) hydrogels provide a promising strategy to develop a class of physically cross-linked networks characterized by exceptional toughness and self-healing properties. However, the precise control of the microstructure and the enhancement of mechanical properties still pose challenges in the field of PEC hydrogels. Herein, we propose a strategy to manipulate the structure of PEC with competitively charged surfactant micelles, leveraging the spatially confined surface charge and excluded volume effects to overcome coacervation issues associated with the PEC, thus achieving a simple one-step preparation of macroscopically uniform and tough PEC hydrogels.
View Article and Find Full Text PDFJ Mater Chem A Mater
December 2024
Faculty of Applied Sciences, Delft University of Technology 2629 JB Delft The Netherlands
Solid-state batteries currently receive ample attention due to their potential to outperform lithium-ion batteries in terms of energy density when featuring next-generation anodes such as lithium metal or silicon. One key remaining challenge is identifying solid electrolytes that combine high ionic conductivity with stability in contact with the highly reducing potentials of next-generation anodes. Fully reduced electrolytes, based on irreducible anions, offer a promising solution by avoiding electrolyte decomposition altogether.
View Article and Find Full Text PDFACS Appl Mater Interfaces
December 2024
Air Force Research Laboratory, 711th Human Performance Wing, Wright-Patterson Air Force Base, Wright-Patterson AFB, Ohio 45433, United States.
Peptides, due to their diverse and controllable properties, are used as both liquid and gas phase recognition elements for both biological and chemical targets. While it is well understood how binding of a peptide to a biomolecule can be converted into a sensing event, there is not the same mechanistic level of understanding with regard to how peptides modulate the selectivity of semiconductor/conductor-based gas sensors. Notably, a rational, mechanistic study has not yet been performed to correlate peptide properties to the sensor response for volatile organic compounds (VOCs) as a function of chemical properties.
View Article and Find Full Text PDFAdv Mater
December 2024
Department of Mechanical and Aerospace Engineering, The Hong Kong University of Science and Technology, Hong Kong, 999077, China.
The ability to rapidly charge batteries is crucial for widespread electrification across a number of key sectors, including transportation, grid storage, and portable electronics. Nevertheless, conventional Li-ion batteries with organic liquid electrolytes face significant technical challenges in achieving rapid charging rates without sacrificing electrochemical efficiency and safety. Solid-state batteries (SSBs) offer intrinsic stability and safety over their liquid counterparts, which can potentially bring exciting opportunities for fast charging applications.
View Article and Find Full Text PDFJ Phys Chem A
December 2024
DTU Chemistry, Technical University of Denmark, Kemitorvet Bldg. 206, 2800 Kgs., Lyngby 2800, Denmark.
We present a new theory for partitioning simulations of periodic and solid-state systems into physically sound atomic contributions at the level of Kohn-Sham density functional theory. Our theory is based on spatially localized linear combinations of crystalline Gaussian-type orbitals and, as such, capable of exposing local features within periodic electronic structures in a more intuitive and robust manner than alternatives based on the spatial distribution of atomic basis functions alone. Early decomposed cohesive energies of both molecular polymers and different crystalline polymorphs demonstrate how the atomic properties yielded by our theory convincingly align with the expected charge polarization in these systems, also whenever partial charges and Madelung energies may lend themselves somewhat ambiguous to interpretation.
View Article and Find Full Text PDFEnter search terms and have AI summaries delivered each week - change queries or unsubscribe any time!