Novel ether-functional spiro-tetronic acid derivatives: molecule design, convenient synthesis and biological evaluation

A novel series of ether functionalization of spiro-tetronic acid derivatives have been designed and conveniently synthesized via three steps, including esterification, one-pot heterocyclization, and etherification reactions. The target molecules have been identified on the basis of analytical spectra data. All newly synthesized compounds have been screened for their potential insecticidal activity against Heliothis armigera and Plutella xylostella compared with spirodiclofen by standard method.     

带电纳米颗粒与相分离的带电生物膜之间相互作用的分子模拟

纳米颗粒在纳米医药、细胞成像等领域有着非常广泛的应用,深入理解纳米颗粒与生物膜之间相互作用的微观机制是纳米颗粒合成与应用的重要基础.本文采用粗粒化分子动力学模拟的方法研究了带电配体包裹的金纳米颗粒与相分离的带电生物膜之间的相互作用.结果表明,通过改变金纳米颗粒表面的配体密度、配体带电种类和比例,以及膜内带电脂分子的种类,可以方便地调控纳米颗粒在膜表面或膜内停留的位置和状态.进一步从自由能的角度分析了带电纳米颗粒与带电生物膜之间相互作用的微观物理机制.本文对纳米粒子在纳米医药、细胞成像等领域的应用具有一定的理论参考意义.     

类氢及碱金属原子激发态寿命的半经典计算公式

根据对应原理,得到了类氢原子能态平均寿命半经典的计算公式τ(n,l),然后利用相对论单通道量子数亏损理论进行推广,得到用来计算考虑总角动量J的激发态寿命公式τ(n,l,l+1/2)和τ(n,l,l-1/2),利用单通道量子数亏损理论得到了碱金属原子n、l远大于1时激发态寿命的半经典公式τ(n.l)=τ0(m+M/nm/v/+M)2v7l(l+1/2)/n4,其计算结果和实验数据符合的很好.     

Standing Waves for Discrete Nonlinear Schrödinger Equations with Nonperiodic Bounded Potentials

Acta Mathematicae Applicatae Sinica, English Series - In this paper, we investigate standing waves in discrete nonlinear Schrödinger equations with nonperiodic bounded potentials. By using the...     

Photoreduction of Alkyl Polyviologens and Their Low Molecular Analogs in PVA Matrix

The photoreduction behavior of alkyl viologen compounds in a PVA matrix was investigated. The initial photoreduction of alkyl viologens and related polyviologens follows second-order reaction kinetics, and the respective rate constants, which vary only slightly with alkyl chain length, were determined. While the polymer effect was not remarkable in a PVA matrix, the association behavior of radical cations was similar to that found in a 2-propanol aqueous solution.     

Hydrothermal synthesis and structural characterization of a one-dimensional coordination polymer [Zn(Pydc)(Dppz)] n (H2Pydc = 2,6-pyridinedicarboxylic acid, Dppz = dipyrido[3,2-a:2′,3′-c]phenazine)

A new metal-organic coordination polymer [Zn(Pydc)(Dppz)] _n (I) (H₂Pydc = 2,6-pyridinedicarboxylic acid, Dppz = dipyrido[3,2-a:2′,3′-c]phenazine) was hydrothermally synthesized and characterized by elemental analysis, IR and X-ray single-crystal diffraction. The X-ray diffraction analysis reveals that I crystallizes in the monoclinic system, space group P2₁/c. The Pydc^2? ligands adopt O,N,O′-tridentate chelating and monodentate bridging coordination mode to link two adjacent Zn2+ ions to form a one-dimensional (1D) zigzag chain. The adjacent chains are further linked through hydrogen bonds and π-π stacking interactions, forming a three-dimensional (3D) supramolecular framework. The unit cell parameters for I: a = 7.332(3) Å, b = 36.023(9) Å, c = 7.8838(13) Å, β = 105.65(3)^○, V = 2005.1(10) ų, Z = 4.     

Enhancing electrochemical performance of LiFePO4 by in situ reducing flexible graphene

Well-dispersed graphene materials reduced by Ac under hydrothermal condition were used as conductive additives to improve intrisic disadvantage of promising LiFePO₄ battery materials, which was synthesized at surface of graphene sheets. The as-prepared LiFePO₄/graphene composites were characterized by X-ray powder diffraction (XRD), scan electron microscopy (SEM), electrochemical impedance spectroscopy (EIS) and galvanostatic charge-discharge tests. The results show that, compared with conventional LiFePO₄ platelets, the composite deliver excellent electrochemical performances, due to flexible graphene-based porous conducting network. We believe that such a facile process will provide a new pathway for further enhancing its energy storage efficiency.