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81.
Dr. Antoine Nitelet Dr. Damien Thevenet Dr. Bruno Schiavi Dr. Christophe Hardouin Dr. Jean Fournier Dr. Rodolphe Tamion Prof. Dr. Xavier Pannecoucke Prof. Dr. Philippe Jubault Prof. Dr. Thomas Poisson 《Chemistry (Weinheim an der Bergstrasse, Germany)》2019,25(13):3262-3266
The copper-photocatalyzed borylation of aryl, heteroaryl, vinyl and alkyl halides (I and Br) was reported. The reaction proceeded using a new heteroleptic Cu complex under irradiation with blue LEDs, giving the corresponding boronic-acid esters in good to excellent yields. The reaction was extended to continuous-flow conditions to allow an easy scale-up. The mechanism of the reaction was studied and a mechanism based on a reductive quenching (CuI/CuI*/Cu0) was suggested. 相似文献
82.
Anaïs Coffinet Dr. David Specklin Dr. Laure Vendier Prof. Dr. Michel Etienne Dr. Antoine Simonneau 《Chemistry (Weinheim an der Bergstrasse, Germany)》2019,25(63):14300-14303
The first example of a formal 1,3-B−H bond addition across the M−N≡N unit of an end-on dinitrogen complex has been achieved. The use of Piers’ borane HB(C6F5)2 was essential to observe this reactivity and it plays a triple role in this transformation: 1) electrophilic N2-borylation agent, 2) Lewis acid in a frustrated Lewis pair-type B−H bond activation, and 3) hydride shuttle to the metal center. This chemistry is supported by NMR spectroscopy and solid-state characterization of products and intermediates. The combination of chelate effect and strong σ donation in the diphosphine ligand 1,2-bis(diethylphosphino)ethane was mandatory to avoid phosphine dissociation that otherwise led to complexes where borylation of N2 occurred without hydride transfer. 相似文献
83.
The batch emulsion copolymerization of vinyl acetate with different vinyl silane functional monomers (vinyl trimethoxysilane [VTMS], vinyl triethoxysilane [VTES], and vinyl silanetriol [VSTO]) is studied. The nature of the silane strongly affects the development of the microstructure and crosslinking ability of the latexes. A combination of techniques (Soxhlet extraction, centrifugation, assymetric‐flow field flow fractionation AF4/MALS/RI) shows that the factor controlling the molar mass and crosslinking density is the degree of hydrolysis of the alkoxysilane, producing higher molar masses and degrees of crosslinking when the degree of hydrolysis is high. Thus, the copolymer containing VSTO produced a very crosslinked latex, the one with VTMS produced a latex with a low degree of crosslinking in the wet state that can yield high degrees of crosslinking upon drying, and the latex with VTES do not produce significant amounts of crosslinking neither before nor after drying. 相似文献
84.
In this paper, we describe a numerical model to simulate the evolution in time of the hydrodynamics of water storage tanks, with particular emphasis on the time evolution of chlorine concentration. The mathematical model contains several ingredients particularly designed for this problem, namely, a boundary condition to model falling jets on free surfaces, an arbitrary Lagrangian–Eulerian formulation to account for the motion of the free surface because of demand and supply of water, and a coupling of the hydrodynamics with a convection–diffusion–reaction equation modeling the time evolution of chlorine. From the numerical point of view, the equations resulting from the mathematical model are approximated using a finite element formulation, with linear continuous interpolations on tetrahedra for all the unknowns. To make it possible, and also to be able to deal with convection‐dominated flows, a stabilized formulation is used. In order to capture the sharp gradients present in the chlorine concentration, particularly near the injection zone, a discontinuity capturing technique is employed. Copyright © 2015 John Wiley & Sons, Ltd. 相似文献
85.
Wen Chen Olivier Maurel Christian La Borderie Thierry Reess Antoine De Ferron Mohammed Matallah Gilles Pijaudier-Cabot Antoine Jacques Frank Rey-Bethbeder 《Heat and Mass Transfer》2014,50(5):673-684
The objective of this study is to simulate the propagation of the shock wave in water due to an explosion. The study is part of a global research program on the development of an alternative stimulation technique to conventional hydraulic fracturing in tight gas reservoirs aimed at inducing a distributed state of microcracking of rocks instead of localized fracture. We consider the possibility of increasing the permeability of rocks with dynamic blasts. The blast is a shock wave generated in water by pulsed arc electrohydraulic discharges. The amplitude of these shock waves is prescribed by the electrohydraulic discharges which generate high pressures of several kilobars within microseconds. A simplified method has been used to simulate the injected electrical energy as augmentation of enthalpy in water locally. The finite element code EUROPLEXUS is used to perform fluid fast dynamic computation. The predicted pressure is consistent with the experimental results. In addition, shock wave propagation characteristics predicted with simulation can be valuable reference for design of underwater structural elements and engineering of underwater explosion. 相似文献
86.
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88.
Hussein Awada Hussein Medlej Sylvie Blanc Marie‐Hélène Delville Roger C. Hiorns Antoine Bousquet Christine Dagron‐Lartigau Laurent Billon 《Journal of polymer science. Part A, Polymer chemistry》2014,52(1):30-38
We demonstrate an efficient strategy to anchor poly(3‐hexylthiophene) (P3HT) onto zinc oxide (ZnO) surfaces. Synthesis of a novel triethoxysilane‐terminated regioregular P3HT is herein reported and supported by thorough characterization. Three triethoxysilane‐terminated P3HTs of different molar masses were prepared via a hydrosilylation reaction from allyl‐terminated P3HT. MALDI‐TOF and 1H NMR were performed to characterize the polymer and show that around 80% of the chains are end‐functionalized. These polymers were then grafted onto the ZnO nanorods to create a macromolecular self‐assembled monolayer. This versatile technique could be subsequently applied to different metal oxide surfaces, such as silicon, titanium, or indium‐tin oxide, and represents a new one‐pot strategy based on triethoxysilane coupling reaction. Importantly, the influence of the molar mass on the grafting density and the polymer shell thickness was studied via thermo gravimetric analysis and transmission electron microscopy. The optical properties of the hybrid materials were determined by UV–visible absorption and photoluminescence to show a quenching effect of P3HT fluorescence by ZnO when grafted. This electronic transfer associated with an improved miscibility of the ZnO@P3HT, makes these hybrid materials suitable candidates for photovoltaic applications. © 2013 Wiley Periodicals, Inc. J. Polym. Sci., Part A: Polym. Chem. 2014 , 52, 30–38 相似文献
89.
In this article, we propose new Monte Carlo techniques for moving a diffusive particle in a discontinuous media. In this framework, we characterize the stochastic process that governs the positions of the particle. The key tool is the reduction of the process to a Skew Brownian motion (SBM). In a zone where the coefficients are locally constant on each side of the discontinuity, the new position of the particle after a constant time step is sampled from the exact distribution of the SBM process at the considered time. To do so, we propose two different but equivalent algorithms: a two-steps simulation with a stop at the discontinuity and a one-step direct simulation of the SBM dynamic. Some benchmark tests illustrate their effectiveness. 相似文献
90.
Michèle Willson Jacques Navech Ramon Burgada 《Phosphorus, sulfur, and silicon and the related elements》2013,188(3):457-467
Abstract The PMR spectra of some spirophosphorans containing the P–C bond are analysed. The results allow us to determine the stereochemistry of these compounds (conformation, stereoisomerism). Le spectre de RMP de quelques spirophosphoranes à liaison P–C est analysé. Les résultats sont utilisés pour préciser la stéréochimie de ces composés (conformation, stéréoisomérie). 相似文献