Results 161 to 170 of about 77,981 (327)

STUDY OF THE PROTONATION OF 1, 2, 4-TRIAZOLE. DFT CALCULATIONS

Journal of Chemistry and Technologies
У цій роботі досліджена реакція між 1,2,4-тріазолом і хлоридною кислотою (HCl) з метою синтезу протонованого 1,2,4-тріазолу (TAH+). Ми використовували розрахунки теорії функціоналу густини (DFT), щоб отримати уявлення про структурний аналіз молекули. Кілька дескрипторів реакційної здатності, включаючи спорідненість до електрона, різниця енергій HOMO ...
El Addali, Abdelahad, El-Kiri, Zakaryae, El Boukili, Abdellah, Saufi, Hamid, Boudad, Lahcen   +4 more
openaire   +2 more sources

Crystal structure of (E)-N′-(4-methoxybenzylidene)-5-methyl-1-(4-tolyl)-1H-1,2,3-triazole-4-carbohydrazide, C₁₉H₁₉N₅O₂ [PDF]

, 2018
Mohammad Hayal Alotaibi
openalex   +1 more source

Synthesis and Glycosidase Inhibition Studies of Novel Exoglycals Targeting GH3 Family Enzymes: Insights from Comparative Analysis with Macrolide Antibiotics

Chemistry – A European Journal, EarlyView.
A series of structurally diverse exoglycals was synthesized using a modified Julia‐olefination approach from sugar‐derived precursors. These glycosidase transition‐state mimics were further diversified via CuAAC chemistry to yield triazole‐conjugated analogues.
Elisa Ospanow, Oscar L. Alferez, David L. Jakeman   +2 more
wiley   +1 more source

Studies on Thiocyanation of Heterocyclic Compounds. IV. Syntheses of Imidazo-[2, 1-b]-1, 3, 4-thiadiazole and Thiazolo [3, 2-b]-s-triazole Derivatives, and Thiocyanation and Bromination of Their Compounds

, 1972
SABURO KANO
openalex   +2 more sources

(E)-3-Methyl-4-[(2-oxidoquinolin-1-ium-3-yl)methyleneamino]-1H-1,2,4-triazole-5(4H)-thioneN,N-dimethylformamide solvate [PDF]

, 2009
Jia Hao Goh, Hoong‐Kun Fun, Airody Vasudeva Adhikari, Balakrishna Kalluraya   +3 more
openalex   +1 more source

Synthesis and Evaluation of the First Generation of Glycosylated Nucleoside Analogues as Potential Inhibitors of the Base J Metabolism in Kinetoplastid Parasites

Chemistry – A European Journal, EarlyView.
Novel analogues of the kinetoplastid‐specific DNA base J unlock a new way to target parasite epigenetic regulation. Some compounds selectively inhibit Leishmania and Trypanosoma species without harming human cells, revealing a promising route toward innovative antiparasitic therapies.
Océane Monfret, Dan Liu, Manon Louis, Sihem Rebei, Dominique Urban, Yann Bourdreux, Elisabeth Mouray, Philippe Grellier, Gilles Doisneau, Dominique Guianvarc'h   +9 more
wiley   +1 more source

Inhibition Effect of N, N'-Dimethylaminoethanol on the Corrosion of Austenitic Stainless Steel Type 304 [PDF]

, 2012
The effect of N,N'-dimethylaminoethanol on the corrosion of austenitic stainless steel type 304 in 3M H2SO4 has been studied by weight-loss method and linear polarization measurement in different concentrations of the compound.
Fedotova, T., Loto, C. A., Loto, R. T.
core   +1 more source

Silent Partners in the Mill: Unveiling the Role of Additives in Mechanochemical Synthesis

Chemistry – A European Journal, EarlyView.
Mechanochemistry offers a sustainable, solvent‐free alternative to traditional synthesis, often enhanced by additives in a process known as additive‐assisted grinding. This review discusses how various additives, including liquids, ionic solids, and advanced materials like ionic liquids and piezoelectric compounds, improve reaction efficiency ...
Johanna Breinsperger, Nika Podlesnik, Francesco Mele, Michael Schnürch   +3 more
wiley   +1 more source

Bifunctional Molecular Switches in Fused Diarylethene–Rhodamine Systems

ChemPhotoChem, EarlyView.
Spectroscopic and time‐dependent density‐functional theory studies show that these novel rhodamine‐based diarylethene (DAE) compounds display intense UV absorption, undergo reversible two‐step protonation involving triazole and rhodamine units, and respond selectively to acid, base, and metal ions.
Bassima Hoteit, Shunan Zhao, Corentin Poidevin, Arnaud Fihey, Keith Man‐Chung Wong, Julien Boixel   +5 more
wiley   +1 more source

Toward Safer and Sustainable Lithium Metal Batteries: Fluorine‐Free Solid Polymer Electrolytes

ENERGY &ENVIRONMENTAL MATERIALS, EarlyView.
An analysis to assess the impact of fluorine in polymer electrolyte‐based lithium metal batteries has been conducted. It has been demonstrated that fluorine‐free LiTIM salt delivers a electrochemical performance similar to that of its fluorinated analogue salts, given the complete lithium dissociation in coordination with PEO and the restricted anion ...
David Fraile‐Insagurbe, Leire Meabe, Brigette Althea Fortuin, Itsaso Segura‐Laparra, Elene Sasieta‐Barrutia, Rosalía Cid, Javier Carrasco, Władysław Wieczorek, Maria Forsyth, Michel Armand, María Martínez‐Ibañez   +10 more
wiley   +1 more source