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Fluorinated organic compounds represent a growing and important family of commercial chemicals. Introduction of fluorine into active ingredients has become an effective way to develop modern crop protection products. Given the particular properties of fluorine and high efficiency and selectivity of diamide insecticides, we designed and synthesized 27 anthranilic diamides analogues containing fluoro-sustituted phenylpyrazole. A preliminary bioassay indicated that most target compounds exhibited good biological activity against Mythimna separata and Plutella xylostella. Compound IIIf containing a 2,4,6-trifluoro-substituted benzene ring showed 43% insecticidal activity against M. https://www.selleckchem.com/products/eapb02303.html separata at 0.1 mg L-1, while the control chlorantraniliprole was 36%. The activity of IIIe against P. xylostella at 10-5 mg L-1 was 94%, compared with that of the control being 70%. Thus, introduction of fluorine into diamide insecticides was useful for increasing activity. Insect electrophysiology studies showed that the calcium concentration in the nerve cells of third M. separata larvae was elevated by IIIf, which further confirmed that ryanodine receptor (RyR) was its potential target.Dielectric actuators are prone to be worn or partially damaged when operating at high electric fields. The introduction of self-healing features into dielectric actuators is favorable for extending its life span and security. Although many attempts have been made to produce self-healing dielectric actuators, most of them focus on the healing of either the electrodes or the dielectric layers. A dielectric actuator that exhibits integral self-healing is still unprecedented. Meanwhile, realizing integral self-healing in dielectric actuator is highly challenging because both the electrode and the dielectric layer need to be healed while the interface between the electrode and the dielectric layer should remain unaffected during the healing process. In this paper, we synthesized self-healing polydimethylsiloxane (PDMS) polymers containing different amounts of polyaniline (PANI) (denoted as PDMS-PANI n , where n represents the weight percentage of PANI) as the dielectric layer and electrode, respectively. PDMS-PANI2.5 polymer exhibits good dielectric properties (ε = 11.11 at 50 Hz) and was used as the dielectric layer, while PDMS-PANI20 polymer having a high conductivity of 4.5 × 10-5 S/cm was used as the electrode. As both of them have excellent self-healing ability and are compatible and diffusible to each other, the entire actuator device can still cause actuated strain after cutting and healing at room temperature for 48 h. Our strategy for realizing integral self-healing of actuator is also applicable to other electronic devices.The molecular mechanics force field Slipids developed in a series of works by Jämbeck and Lyubartsev (J. Phys. Chem. B2012, 116, 3164-3179; J. Chem. Theory Comput.2012, 8, 2938-2948) generally provides a good description of various lipid bilayer systems. However, it was also found that order parameters of C-H bonds in the glycerol moiety of the phosphatidylcholine headgroup deviate significantly from NMR results. In this work, the dihedral force field parameters have been reparameterized in order to improve the agreement with experiment. For this purpose, we have computed energies for a large amount of lipid headgroup conformations using density functional theory on the B3P86/cc-pvqz level and optimized dihedral angle parameters simultaneously to provide the best fit to the quantum chemical energies. The new parameter set was validated for three lipid bilayer systems against a number of experimental properties including order parameters, area per lipid, scattering form factors, bilayer thickness, area compressibility and lateral diffusion coefficients. In addition, the order parameter dependence on cholesterol content in the POPC bilayer was investigated. It is shown that the new force field significantly improves agreement with the experimental order parameters for the lipid headgroup while keeping good agreement with other experimentally measured properties.Here, we report our findings related to the structural and electronic considerations that influence the rate of oxygen-atom transfer (OAT) to oxygen-deficient polyoxovanadate alkoxide (POV-alkoxide) clusters ([V6O6(OC2H5)12] n ; n = 1-, 0, 1+). A comparison of the reaction times required for the reduction of nitrogen-containing oxyanions (NO x -, x = 2, 3) by the POV-ethoxide cluster in its anionic (1-V 6 O 6 1- ; VIIIVIV5), neutral (4-V 6 O 6 0 ; VIIIVIV4VV), or cationic (6-V 6 O 6 1+ ; VIIIVIV3VV2) charge state reveals that OAT is significantly influenced by three factors (1) ion-pairing interactions between the POV-alkoxide and the negatively charged oxyanion; (2) oxidation states of remote vanadyl ions in the Lindqvist assembly; (3) the steric bulk surrounding the coordinatively unsaturated VIII ion. This work provides atomic-level insight related to structure-function relationships that govern the rate of OAT at metal oxide surfaces using polyoxometalate clusters as molecular models.Materials with high second harmonic generation (SHG) efficiency and reduced dimensions are favorable for integrated photonics and nonlinear optical applications. Here, we fabricate MoS2 nanoscrolls with different chiralities and study their SHG performances. As a 1D material, MoS2 nanoscroll shows reduced symmetry and strong chirality dependency in the polarization-resolved SHG characterizations. This SHG performance can be well explained by the superposition theory of second harmonic field of the nanoscroll walls. MoS2 nanoscrolls with certain chiralities and diameters in our experiment can have SHG intensity up to 95 times stronger than that of monolayer MoS2, and the full potential can still be further exploited. The same chirality-dependent SHG can be expected for nanoscrolls or nanotubes composed of other noncentrosymmetric 2D materials, such as WS2, WSe2, and hBN. The characterization and analysis results presented here can also be exploited as a nondestructive technique to determine the chiralities of these nanoscrolls and nanotubes.
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