Synthesis of ferrocenyl pyrazoles by the reaction of (2-formyl-1-chlorovinyl)ferrocene with hydrazines

Synthesis of ferrocenyl-substituted pyrazoles via the reaction between (2-formyl-1-chlorovinyl)ferrocene and hydrazine derivatives is described. Depending upon the substitution pattern of hydrazine, the reaction affords 1-alkyl/aryl-5-ferrocenylpyrazoles and/or 1-alkyl/aryl-3-ferrocenylpyrazoles. The reaction appears to be general for a variety of hydrazine derivatives.     

Stereospecific synthesis of a new class of aminocyclitol with the conduramine D-2 configuration

A new aminocyclitol derived from bicyclo[4.2.0^1,6]octane was synthesized starting from cyclooctatetraene. Photooxygenation of trans-7,8-diacetoxy-bicyclo[4.2.0]octa-2,4-diene afforded a bicyclic endoperoxide. Reduction of the endoperoxide with thiourea followed by a palladium-catalyzed ionization/cyclization reaction gave an oxazolidinone derivative. Oxidation of the double bond in the oxazolidinone with KMnO₄ followed by acetylation gave the oxazolidinone-tetraacetate whose exact configuration was determined by X-ray diffraction analysis. Hydrolysis of the oxazolidinone ring and removal of the acetate groups furnished the desired aminocyclitol.     

Exact solution of Schrödinger equation with deformed ring-shaped potential

Exact solution of the Schrödinger equation with deformed ring-shaped potential is obtained in the parabolic and spherical coordinates. The Nikiforov–Uvarov method is used in the solution. Eigenfunctions and corresponding energy eigenvalues are calculated analytically. The agreement of our results is good.AMS Subject Classification: 03.65.–w, 12.39.Jh, 21.10.–k     

Cyclotrimerization of ‘Oxabenzonorbornadiene’: Synthesis of syn‐ and anti‐5,6,11,12,17,18‐Hexahydro‐5,18:6,11:12,17‐triepoxytrinaphthylene

An efficient synthetic route to the concave‐shaped, potentially ionophoric syn‐ and anti‐isomers of 5,6,11,12,17,18‐hexahydro‐5,18:6,11:12,17‐triepoxytrinaphthylene ( 4 ) was elaborated. Starting from ‘oxabenzonorbornadiene’ ( 5 ), the stannylated precursor 9 was prepared in three steps, followed by cyclotrimerization catalyzed by copper(I) thiophene‐2‐carboxylate (CuTC) , which afforded 4 in a syn/anti ratio of 5 : 4.     

Enhancing electrochromic properties of conducting polymers via copolymerization: Copolymer of 1‐(4‐fluorophenyl)‐2,5‐di(thiophen‐2‐yl)‐1H‐pyrrole with 3,4‐ethylene dioxythiophene

A copolymer of 1‐(4‐fluorophenyl)‐2,5‐di(thiophen‐2‐yl)‐1H‐pyrrole (FPTP) with 3,4‐ethylene dioxythiophene (EDOT) was electrochemically synthesized and characterized. While poly(FPTP) (P(FPTP)) has only two colors in its oxidized and neutral states (blue and yellow), its copolymer with EDOT has five different colors (purple, red, light gray, green, and blue). Electrochromic devices based on P(FPTP‐co‐EDOT) and poly(3,4‐ethylenedioxythiophene) (PEDOT) were constructed and characterized. The oxidized state of the device shows blue color whereas it shows purple for the reduced state. At several potentials the device has good transparency with green and gray colors. Maximum contrast (Δ%T) and switching time of the device were measured as 23% and 1.1 s at 555 nm. © 2007 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 45: 4496–4503, 2007     

Determination of the external field amplitude and deviation parameter through expectation value based quantum optimal control of multiharmonic oscillators under linear control agents

This work focuses on the optimal control of a quantum system composed of harmonic oscillators under linear control agents (dipole function, objective operator, and the penalty operator whose expectation value is to be suppressed). The main purpose of the work is to determine the temporal external field amplitude function. Paper recalls the formulation of the optimal control equations first. Then a set of ordinary differential equations over the expectation values of certain unknown entities is constructed. These temporal differential equations have time varying coefficients unless the weight functions appearing in the cost functional are constant. Certain accompanying conditions are needed to get unique solutions. Investigations show that one half of the conditions should be given at the initial instant and the other half should be specified at the final moment. Since the differential equations contain another unknown entity, deviation parameter, solutions must satisfy an algebraic equation derived from the definition of this parameter. Results do not involve the explicit structure of the wave function and costate function. Only the external field amplitude and the deviation parameter are determined here. The evaluation of the wave function and costate function needs additional treatments to the control equations. We report certain analytical results for external field amplitude and the deviation parameter and give certain illustrative implementations to finalize the paper.     

Reverse bullwhip effect in pricing

Price variability is one of the major causes of the bullwhip effect. This paper analyzes the impact of procurement price variability in the upstream of a supply chain on the downstream retail prices. Procurement prices may fluctuate over time, for example, when the supply chain players deploy auction type procurement mechanisms, or if the prices are dictated in market exchanges. A game theory framework is used here to model a serial supply chain. Sequential price game scenarios are investigated to show that there is an increase in retail price variability and an amplified reverse bullwhip effect on prices (RBP) under certain demand conditions.     

Synthesis,characterization and catalytic activity of novel Co(II) and Pd(II)‐perfluoroalkylphthalocyanine in fluorous biphasic system; benzyl alcohol oxidation

Tetrakis[heptadecafluorononyl] substituted phthalocyanine complexes were prepared by template synthesis from 4‐(heptadecafluorononyloxy)phthalonitrile with Co(CH₃COO)^·₂H₂O or PdCl₂ in 2‐N, N‐dimethylaminoethanol. The corresponding phthalonitrile was obtained from heptadecafluorononan‐1‐ol and 4‐nitrophthalonitrile with K₂CO₃ in DMF at 50 °C. The structures of the compounds were characterized by elemental analysis, FTIR, UV–vis and MALDI‐TOF MS spectroscopic methods. Metallophthalocyanines are soluble in fluoroalkanes such as perfluoromethylcyclohexane (PFMCH). The complexes were tested as catalysts for benzyl alcohol oxidation with tert‐butylhydroperoxide (TBHP) in an organic–fluorous biphasic system (n‐hexane–PFMCH). The oxidation of benzyl alcohol was also tested with different oxidants, such as hydrogen peroxide, m‐chloroperoxybenzoic acid, molecular oxygen and oxone in n‐hexane–PFMCH. TBHP was found to be the best oxidant for benzyl alcohol oxidation since higher conversion and selectivity were observed when this oxidant was used. Copyright © 2008 John Wiley & Sons, Ltd.     

Synthesis and characterization of novel cofacial bis-phthalocyanines containing 16-crown-5 ether groups

Four crown ether substituted cofacial bis-phthalocyanines were prepared by the cyclic condensation of dihydroxy groups of pentaerythritol moieties of phthalocyanine with tetraethyleneglycol ditosylate in the presence of NaH as base in refluxing THF.