Ultrasonic irradiation of the ullmann condensation: Application to the preparation of dioxolo,dioxino, cyclopent,and imidazolo anthranilic acid derivatives

The synthesis of N‐aryl anthranilic acid derivatives bearing dioxolo, dioxino, cyclopent, and imidazolo supplementary ring systems is reported. The Ullmann‐Goldberg condensation of the N‐aryl anthranilic acid is improved in yield and reaction time, compared to conventional heating; by ultrasonic irradiation.     

Correlated AFM and SERS imaging of the transition from nanotriangle to nanohole arrays

Mapping the transition of Ag nanotriangle to nanohole arrays revealed that the optimal SERS response was obtained near the transition. Correlated AFM and Raman imaging provided novel experimental proof that hot spots are located on Ag islands for nanotriangle arrays and in the core area of the hole for nanohole arrays, which is in agreement with previous theoretical predictions.     

The functional valency of dodecamannosylated fullerenes with Escherichia coli FimH--towards novel bacterial antiadhesives

Fullerene hexakis-adducts bearing 12 peripheral mannose moieties have been prepared by grafting sugar derivatives onto the fullerene core and assayed as inhibitors of FimH, a bacterial adhesin, using isothermal titration calorimetry, surface plasmon resonance and hemagglutination assays.     

A new proof of the uniqueness of the flow for ordinary differential equations with <Emphasis Type="Italic">BV</Emphasis> vector fields

We provide in this article a new proof of the uniqueness of the flow solution to ordinary differential equations with BV vector fields that have divergence in L ^∞ (or in L ¹), when the flow is assumed nearly incompressible (see the text for the definition of this term). The novelty of the proof lies in the fact it does not use the associated transport equation.     

Temperature can enhance coherent oscillations at a Landau-Zener transition

We consider sweeping a system through a Landau-Zener avoided crossing, when that system is also coupled to an environment or noise. Unsurprisingly, we find that decoherence suppresses the coherent oscillations of quantum superpositions of system states, as superpositions decohere into mixed states. However, we also find an effect we call "Lamb-assisted coherent oscillations," in which a Lamb shift exponentially enhances the coherent-oscillation amplitude. This dominates for high-frequency environments such as super-Ohmic environments, where the coherent oscillations can grow exponentially as either the environment coupling or temperature are increased. The effect could be used as an experimental probe for high-frequency environments in such systems as molecular magnets, solid-state qubits, spin-polarized gases (neutrons or He3), or Bose condensates.     

Global Bifurcation Diagrams of Steady States of Systems of PDEs via Rigorous Numerics: a 3-Component Reaction-Diffusion System

In this paper, we use rigorous numerics to compute several global smooth branches of steady states for a system of three reaction-diffusion PDEs introduced by Iida et al. [J. Math. Biol. 53(4):617–641, 2006] to study the effect of cross-diffusion in competitive interactions. An explicit and mathematically rigorous construction of a global bifurcation diagram is done, except in small neighborhoods of the bifurcations. The proposed method, even though influenced by the work of van den Berg et al. [Math. Comput. 79(271):1565–1584, 2010], introduces new analytic estimates, a new gluing-free approach for the construction of global smooth branches and provides a detailed analysis of the choice of the parameters to be made in order to maximize the chances of performing successfully the computational proofs.     

Computing the Longest Previous Factor

The Longest Previous Factor   array gives, for each position i$i$ in a string y$y$, the length of the longest factor (substring) of y$y$ that occurs both at i$i$ and to the left of i$i$ in y$y$. The Longest Previous Factor array is central in many text compression techniques as well as in the most efficient algorithms for detecting motifs and repetitions occurring in a text. Computing the Longest Previous Factor array requires usually the Suffix Array and the Longest Common Prefix array. We give the first time–space optimal algorithm that computes the Longest Previous Factor array, given the Suffix Array and the Longest Common Prefix array. We also give the first linear-time algorithm that computes the permutation that applied to the Longest Common Prefix array produces the Longest Previous Factor array.     

Multicore Capsules: Thermo‐Stimulable Wax@Water@SiO2 Multicore‐Shell Capsules (Part. Part. Syst. Charact. 2/2013)

Complex wax@water@SiO₂ multicore capsules are synthesized by combining sol‐gel process and formulation of wax‐in‐water‐in‐oil double emulsions. The inner direct wax‐in‐water emulsion is stabilized with modified silica nanoparticles using limited coalescence occurring in Pickering emulsions. In a second step, this obtained liquid dispersion is emulsified in poly‐dimethylsiloxane (PDMS) using a non ionic surfactant to stabilize the second water/oil interface. Finally, a sol‐gel process is employed to mineralize the as‐generated double emulsions giving rise to wax@water@SiO₂ multicore capsules. Due to the wax volume expansion through melting, the as‐synthesized multicore capsules offer thermally stimulated release that is enhanced when surfactant is added in the surrounding continuous oil phase. In addition, the melted wax release can be tuned from a one‐step process to a more sequential dropping mode by varying the mineral precursor tetraethoxy‐orthosilane (TEOS) concentration in the oily phase during mineralization.     

Solution and Solid-State Photophysical Properties of Positional Isomeric Acrylonitrile Derivatives with Core Pyridine and Phenyl Moieties: Experimental and DFT Studies

The compounds I (Z)-2-(phenyl)-3-(2,4,5-trimethoxyphenyl)acrylonitrile with one side (2,4,5-MeO-), one symmetrical (2Z,2′Z)-2,2′-(1,4-phenylene)bis(3-(2,4,5-trimethoxyphenyl)acrylonitrile), II (both sides with (2,4,5-MeO-), and three positional isomers with pyridine (Z)-2-(pyridin-2- 3, or 4-yl)-3-(2,4,5-trimethoxyphenyl)acrylonitrile, III–V were synthetized and characterized by UV-Vis, fluorescence, IR, H¹-NMR, and EI mass spectrometry as well as single crystal X-ray diffraction (SCXRD). The optical properties were strongly influenced by the solvent (hyperchromic and hypochromic shift), which were compared with the solid state. According to the solvatochromism theory, the excited-state (μ_e) and ground-state (μ_g) dipole moments were calculated based on the variation of Stokes shift with the solvent’s relative permittivity, refractive index, and polarity parameters. SCXRD analyses revealed that the compounds I and II crystallized in the monoclinic system with the space group, P2₁/n and P2₁/c, respectively, and with Z = 4 and 2. III, IV, and V crystallized in space groups: orthorhombic, Pbca; triclinic, P-1; and monoclinic, P2₁ with Z = 1, 2, and 2, respectively. The intermolecular interactions for compounds I–V were investigated using the CCDC Mercury software and their energies were quantified using PIXEL. The density of states (DOS), molecular electrostatic potential surfaces (MEPS), and natural bond orbitals (NBO) of the compounds were determined to evaluate the photophysical properties.