Synthesis and application of new Schiff base Mn(III) complexes containing crown ether rings as catalysts for oxidation of cyclohexene and cyclooctene by Oxone

Six catalysts MnClL¹–MnClL⁶, containing two crown ether rings, were synthesised and characterised by IR spectroscopy and CHN microanalysis. A combination of Oxone, as oxidant, and these catalysts was used for the oxidation of cyclohexene and cyclooctene. Among the prepared catalysts, MnClL³ and MnClL⁴ exhibited the best catalytic efficiency. Catalysts MnClL¹, MnClL² and MnClL⁶ showed a moderate efficiency and MnClL¹ showed the lowest efficiency. Comparison of MmclL¹–MnClL⁴ and MnClL⁶ containing crown ether rings with an identical mixture of uncrowned complex MnClL⁷ [manganese N,N′-bis(salicylidene)ethylenediamine chloride] and crown ether 2 (4′-hydroxybenzo-15-crown-5), revealed a more important role for the crown ether than increasing solubility of Oxone in the organic phase. The effect on reaction times and chemical yields of temperature, pyridine as the axial base, and different alkali metal salts was also investigated.     

One-pot synthesis of imidazo[1,2-a]pyridines from benzyl halides or benzyl tosylates, 2-aminopyridines and isocyanides

A one-pot synthesis of imidazo[1,2-a]pyridines is described. Benzyl halides or benzyl tosylates are oxidized to aldehydes under mild Kornblum conditions which then undergo a three-component reaction with various 2-aminopyridines and isocyanides to afford the imidazo[1,2-a]pyridines in excellent yields.     

An accurate empirical correlation for predicting natural gas viscosity

Natural gas viscosity is an important parameter in many gas and petroleum engineering calculations.This study presents a new empirical model for quickly calculating the natural gas viscosity.The model was derived from 4089 experimental viscosity data with varieties ranging from 0.01 to 21,and 1 to 3 of pseudo reduced pressure and temperature,respectively.The accuracy of this new empirical correlation has been compared with commonly used empirical models,including Lee et al.,Heidaryan et al.,Carr et al.,and Adel Elsharkawy correlations.The comparison indicates that this new empirical model can predict viscosity of natural gas with average absolute relative deviation percentage AARD (%) of 2.173.     

An Optimized Three-Level Design of Decoder Based on Nanoscale Quantum-Dot Cellular Automata

Quantum-dot Cellular Automata (QCA) has been potentially considered as a supersede to Complementary Metal–Oxide–Semiconductor (CMOS) because of its inherent advantages. Many QCA-based logic circuits with smaller feature size, improved operating frequency, and lower power consumption than CMOS have been offered. This technology works based on electron relations inside quantum-dots. Due to the importance of designing an optimized decoder in any digital circuit, in this paper, we design, implement and simulate a new 2-to-4 decoder based on QCA with low delay, area, and complexity. The logic functionality of the 2-to-4 decoder is verified using the QCADesigner tool. The results have shown that the proposed QCA-based decoder has high performance in terms of a number of cells, covered area, and time delay. Due to the lower clock pulse frequency, the proposed 2-to-4 decoder is helpful for building QCA-based sequential digital circuits with high performance.     

Silicon carbide nanotubes (SiCNTs) serving for catalytic decomposition of toxic diazomethane (DAZM) gas: a DFT study

In the present study, the adsorption and decomposition of diazomethane (DAZM) on the surface of (6,0) zigzag silicon carbide nanotube (SiCNT) are investigated using density functional theory calculations. The geometry structures of the three stable configurations, adsorption energies and electronic properties of DAZM adsorption on the surface of SiCNT are investigated. It was found that the DAZM molecule is decomposed over the surface of (6,0) SiCNT with activation energy (E_act) of 0.523 eV. The curvature effect on the adsorption energies of the DAZM molecule is also considered by studying (5,0) and (7,0) SiCNTs. The results display that DAZM adsorption over smaller diameter of SiCNT is thermodynamically more favourable than larger one.