Solar thermochemical reactions Ⅱ： Synthesis of 2-aminothiophenes via Gewald reaction induced by solar thermal energy

Green conditions have been developed for the synthesis of substituted 2-aminothiophenes employing multicomponent reactions of a ketone with active methylene nitrile and elemental sulphur induced by free solar thermal energy.     

Platinum oxide catalyzed hydrosilylation of unsymmetrical internal aryl alkynes under ortho-substituent regiocontrol

[chemical reaction: see text]. PtO2- and H2PtCl6-catalyzed hydrosilylation of internal aryl alkynes having a para or an ortho substituent with triethylsilane are discussed and compared. The regioselectivity of the H-Si bond addition was found to be controlled by the ortho substituent rather than the nature of the platinum catalyst. Arylalkynes with an ortho substituent, regardless of its electronic nature, directed the silyl substituent mainly to the alpha-position. PtO2 proved to be a versatile and powerful catalyst compared to H2PtCl6 since it prevents the alkyne reduction.     

Synthesis of racemic nitramine, isonitramine and sibirine

Condensation of enol ether 6 with methyl vinyl ketone led easily to ketoaldehyde 7 whose cyclisation afforded the azaspiranic enone 8, a key intermediate for the synthesis of the title alkaloids.     

Novel Pentaheterocycles. First General Synthesis Entry to Functionalized Derivatives of Pyrido[2,3-f:6,5-f'']di[1,2,4]triazolo[4,3-a] pyrimidin-5(1H)-ones

Summary. Thirteen derivatives of the novel title ring system were synthesized via a two-step procedure that utilizes hydrazonoyl chlorides and pyridodipyrimidinones as starting materials. The mechanism and regiochemistry of the reactions studied are discussed and the compounds prepared were characterized by alternate synthesis, spectra (mass, IR, ¹H and ¹³C NMR), and elemental analyses.     

Alkylation en catalyse par transfert de phase d'une série d'acridanone-9 substituées: Compétition entre O- et N-alkylation

Substituted acridanones were alkylated under phase transfer catalysis conditions. In so doing, a mixture of O- and N-alkyl derivatives was prepared. Orientation of the reaction products depends upon the alkylating agent but not on the position of the substituent. Hence, HSAB principles can explain this orientation.     

On the nature of antimicrobial activity: a model for protegrin-1 pores

We conducted over 150 ns of simulation of a protegrin-1 octamer pore in a lipid bilayer composed of palmitoyloleoyl-phosphatidylethanolamine (POPE) and palmitoyloleoyl-phosphatidylglycerol (POPG) lipids mimicking the inner membrane of a bacterial cell. The simulations improve on a model of a pore proposed from recent NMR experiments and provide a coherent understanding of the molecular mechanism of antimicrobial activity. Although lipids tilt somewhat toward the peptides, the simulated protegrin-1 pore more closely follows the barrel-stave model than the toroidal-pore model. The movement of ions is investigated through the pore. The pore selectively allows negatively charged chloride ions to pass through at an average rate of one ion every two nanoseconds. Only two events are observed of sodium ions crossing through the pore. The potential of mean force is calculated for the water and both ion types. It is determined that the chloride ions move through the pore with ease, similarly to the water molecules with the exception of a zone of restricted movement midway through the pore. In bacteria, ions moving through the pore will compromise the integrity of the transmembrane potential. Without the transmembrane potential as a countermeasure, water will readily flow inside the higher osmolality cytoplasm. We determine that the diffusivity of water through a single PG-1 pore is sufficient to cause fast cell death by osmotic lysis.     

Robust stability of uncertain piecewise-linear systems: LMI?approach

In this paper we propose sufficient conditions for the robust stability of time-invariant uncertain piecewise-linear systems using homogeneous polynomial Lyapunov functions. The proposed conditions are expressed in terms of linear matrix inequalities, which can be numerically determined. We solve the stabilization of piecewise uncertain linear control systems by using state piecewise-linear feedback. We propose an illustrative example to show the efficiency of the proposed approach.     

Search for technicolor with DELPHI

Technicolor represents a viable alternative to the Higgs mechanism for generating gauge boson masses. Searches for technicolor particles and have been performed in the data collected by the DELPHI experiment at LEP at centre-of-mass energies between 192 and 208 GeV corresponding to an integrated luminosity of 452 pb. Good agreement is observed with the SM expectation in all channels studied. This is translated into an excluded region in the plane. The production is excluded for all GeV/c. Assuming a point-like interaction of the with gauge bosons, an absolute lower limit on the charged mass at 95% CL is set at 79.8 GeV/c, independently of other parameters of the technicolor model. Received: 10 August 2001 / Published online: 5 November 2001     

Light element opacities from ATOMIC

We present new calculations of local-thermodynamic-equilibrium (LTE) light element opacities from the Los Alamos ATOMIC code. ATOMIC is a multi-purpose code that can generate LTE or non-LTE quantities of interest at various levels of approximation. A program of work is currently underway to compute new LTE opacity data for all elements H through Zn. New opacity tables for H through Ne are complete, and a new Fe opacity table will be available soon. Our calculations, which include fine-structure detail, represent a systematic improvement over previous Los Alamos opacity calculations using the LEDCOP legacy code. Our opacity calculations incorporate atomic structure data computed from the CATS code, which is based on Cowan's atomic structure codes, and photoionization cross section data computed from the Los Alamos ionization code GIPPER. We make use of a new equation-of-state (EOS) model based on the chemical picture. ATOMIC incorporates some physics packages from LEDCOP and also includes additional physical processes, such as improved free–free cross sections and additional scattering mechanisms. In this report, we briefly discuss the physics improvements included in our new opacity calculations and present comparisons of our new opacities with other work for C, O, and Fe at selected conditions.