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91.
92.
The NMR spin–spin scalar coupling constants (JHH's) of closely contacting, but non-bonded hydrogen atoms in a series of highly strained molecules (including a new in,in-cyclophane made specifically for this study) have been examined both experimentally and computationally. The experimental JHH's are invariably quite small (0.1–0.6 Hz), but common DFT methods with modest basis sets nearly always overestimate these values, by factors of 10–30, and even with quite large basis sets (up to cc-pVQZ) the JHH's of two of the molecules are overestimated by a factor of 10 or more. Possible reasons for these discrepancies are discussed. 相似文献
93.
Leblond Sylvain Fichet Pascal Laumonier Rmi Billon Sophie Sardini Paul Colas Kimberly 《Journal of Radioanalytical and Nuclear Chemistry》2022,331(2):1075-1089
Journal of Radioanalytical and Nuclear Chemistry - A new method has been developed to image surface contamination on-site by short range radiation emitters (such as alpha or beta particle... 相似文献
94.
M. R. Ajayakumar Marco Di Giovannantonio Carlo A. Pignedoli Lin Yang Pascal Ruffieux Ji Ma Roman Fasel Xinliang Feng 《Journal of polymer science. Part A, Polymer chemistry》2022,60(12):1912-1917
The precise introduction of nonplanar pores in the backbone of graphene nanoribbon represents a great challenge. Here, we explore a synthetic strategy toward the preparation of nonplanar porous graphene nanoribbon from a predesigned dibromohexabenzotetracene monomer bearing four cove-edges. Successive thermal annealing steps of the monomers indicate that the dehalogenative aryl-aryl homocoupling yields a twisted polymer precursor on a gold surface and the subsequent cyclodehydrogenation leads to a defective porous graphene nanoribbon containing nonplanar [14]annulene pores and five-membered rings as characterized by scanning tunneling microscopy and noncontact atomic force microscopy. Although the C–C bonds producing [14]annulene pores are not achieved with high yield, our results provide new synthetic perspectives for the on-surface growth of nonplanar porous graphene nanoribbons. 相似文献
95.
Pascal Rusch Denis Pluta Dr. Franziska Lübkemann Dr. Dirk Dorfs Dr. Dániel Zámbó Prof. Nadja C. Bigall 《Chemphyschem》2022,23(2):e202100755
Employing nanocrystals (NCs) as building blocks of porous aerogel network structures allows the conversion of NC materials into macroscopic solid structures while conserving their unique nanoscopic properties. Understanding the interplay of the network formation and its influence on these properties like size-dependent emission is a key to apply techniques for the fabrication of novel nanocrystal aerogels. In this work, CdSe/CdS dot/rod NCs possessing two different CdSe core sizes were synthesized and converted into porous aerogel network structures. Temperature-dependent steady-state and time-resolved photoluminescence measurements were performed to expand the understanding of the optical and electronic properties of these network structures generated from these two different building blocks and correlate their optical with the structural properties. These investigations reveal the influence of network formation and aerogel production on the network-forming nanocrystals. Based on the two investigated NC building blocks and their aerogel networks, mixed network structures with various ratios of the two building blocks were produced and likewise optically characterized. Since the different building blocks show diverse optical response, this technique presents a straightforward way to color-tune the resulting networks simply by choosing the building block ratio in connection with their quantum yield. 相似文献
96.
Hippolyt L. Greve Marcel Kaiser Pascal Mser Thomas J. Schmidt 《Molecules (Basel, Switzerland)》2021,26(12)
In continuation of our search for leads from medicinal plants against protozoal pathogens, we detected antileishmanial activity in polar fractions of a dichloromethane extract from Boswellia serrata resin. 11-keto-β-boswellic acid (KBA) could be isolated from these fractions and was tested in vitro against Leishmania donovani axenic amastigotes along with five further boswellic acid derivatives. 3-O-acetyl-11-keto-β-boswellic acid (AKBA) showed the strongest activity with an IC50 value of 0.88 µM against axenic amastigotes but was inactive against intracellular amastigotes in murine macrophages 相似文献
97.
Bruno Oyallon Marie Brachet-Botineau Cdric Log Thomas Robert Stphane Bach Sajida Ibrahim William Raoul Ccile Croix Pascal Berthelot Jean Guillon Noël Pinaud Fabrice Gouilleux Marie-Claude Viaud-Massuard Caroline Denevault-Sabourin 《Molecules (Basel, Switzerland)》2021,26(4)
Proviral integration site for Moloney murine leukemia virus (Pim)-1/2 kinase overexpression has been identified in a variety of hematologic (e.g., multiple myeloma or acute myeloid leukemia (AML)) and solid (e.g., colorectal carcinoma) tumors, playing a key role in cancer progression, metastasis, and drug resistance, and is linked to poor prognosis. These kinases are thus considered interesting targets in oncology. We report herein the design, synthesis, structure–activity relationships (SAR) and in vitro evaluations of new quinoxaline derivatives, acting as dual Pim1/2 inhibitors. Two lead compounds (5c and 5e) were then identified, as potent submicromolar Pim-1 and Pim-2 inhibitors. These molecules were also able to inhibit the growth of the two human cell lines, MV4-11 (AML) and HCT-116 (colorectal carcinoma), expressing high endogenous levels of Pim-1/2 kinases. 相似文献
98.
Depending on the solvothermal reaction conditions, we obtained three different metal-organic frameworks with yttrium(III) as metal component and 2,5-dihdyroxyterepthalic acid (H4dhtp) as bifunctional organic linker: Y2(H2dhtp)3(dmf)4 · (dmf)2 (CPO-29) contains dinuclear, paddle-wheel like inorganic secondary building units (SBUs) connected by the organic linker to a network with α-Po topology, while Y2(H2dhtp)(dhtp)(dmf)2 (CPO-30) and Y2(H2dhtp)(dhtp)(dmf)2(H2O)2 · (H2O)4 (CPO-31) contain one-dimensional inorganic SBUs that differ in how the half- and fully deprotonated ligands are connected to and arranged around them. Only the carboxylic acid groups of the organic linker are deprotonated in CPO-29, while CPO-30 and CPO-31 contain both 2,5-dihydroxyterephthalate (H2dhtp2–) linkers and fully deprotonated 2,5-dioxidoterephthalate (dhtp4–) linkers. All three compounds contain large volumes filled with solvent, but we were able to demonstrate permanence of porosity only for CPO-30. Variable temperature powder X-ray diffraction reveals that CPO-29 and CPO-31 undergo discontinuous phase transitions upon heating, and the flexibility of the framework structure indicated by these might be the reason for the inability to access the pore volume. Desolvated CPO-30 and CPO-31 are polymorphs, whose network structures differ in whether the H2dhtp2– and dhtp4– linkers are located in cis or trans arrangement around the inorganic SBU. 相似文献
99.
Baudat Emilie Gautier Céline Fichet Pascal Destrel Eric Colin Christèle Giuliani Margaux Lambrot Gabriel 《Journal of Radioanalytical and Nuclear Chemistry》2021,328(2):637-650
Journal of Radioanalytical and Nuclear Chemistry - 90Sr radiochemical method using nitric acid for Sr and Ca separation was optimized using design of experiments methodology. Nitric acid... 相似文献
100.
Pascal L. W. Welzen Sydney W. Martinez Ciriano Shoupeng Cao Alexander F. Mason Imke A. B. Welzen-Pijpers Jan C. M. van Hest 《Journal of polymer science. Part A, Polymer chemistry》2021,59(12):1241-1252
Polymersomes have gained much interest within the biomedical field as drug delivery systems due to their ability to transport and protect cargo from the harsh environment inside the body. For an improved drug efficacy, control over cargo release is however also an important factor to take into account. An often employed method is to incorporate pH sensitive groups in the vesicle membrane, which induce disassembly and content release when the particles have reached a target site in the body with the appropriate pH, such as the acidic microenvironment of tumor tissue or the endosome. In this paper, biodegradable poly(ethylene glycol)-poly(caprolactone-gradient-trimethylene carbonate)-based polymeric vesicles have been developed with disassembly features at mild acidic conditions. Modifying the polymer backbone with imidazole moieties results in vesicle disassembly upon protonation due to the lowered pH. Furthermore, upon increasing the pH efficient re-assembly into vesicles is observed due to the switchable amphiphilic nature of the polymer. When this re-assembly process is conducted in presence of cargo, enhanced encapsulation is achieved. Furthermore, the potency of the polymeric system for future biomedical applications such as adjuvant delivery is demonstrated. 相似文献