A Modified Peng–Robinson Equation of State for Heavy Hydrocarbons

Russian Journal of Physical Chemistry A - A new simple and accurate functional form for an attractive parameter α is introduced for Peng–Robinson equation of state. The modified...     

Superb catalytic properties of nickel cobalt bimetallic nanoparticles immobilized on 3D nitrogen-doped graphene for thermal decomposition of ammonium perchlorate

Research on Chemical Intermediates - Nickel cobalt bimetallic nanoparticles (NiCo NPs) with different molar ratios were stabilized over three-dimensional nitrogen-doped graphene [3D-(N)G] by a...     

用于BNCT-SPECT的帕维亚TRIGA MARK II反应堆热柱优化设计

针对坐落于意大利帕维亚大学的TRIGA Mark II反应堆热柱结构进行优化设计,从而满足面向硼中子俘获治疗(BNCT)的单光子发射计算机断层成像(SPECT)研究要求。为提高计算效率并减小统计误差,对比分析使用SSW/SSR方法与直接使用反应堆为源项时热柱内照射位置处中子能谱,其结果基本一致,从而验证了SSW/SSR方法的可靠性。为在该反应堆开展BNCT中SPECT实验,热柱中子束需准直为笔形束。对比分析四种热柱优化方案下束流口处及探测器处热中子和光子通量：40 cm长石墨(射束口5 cm3 cm);0.5 cm厚硼包裹40 cm长石墨(射束口5 cm3 cm);30 cm长天然锂聚乙烯(射束口直径4 cm);30 cm长天然锂聚乙烯(20 cm长射束口直径5 cm,5 cm长射束口直径4 cm,5 cm长射束口直径2 cm)。结果显示,射束口处热中子通量分别为1.05108,2.52107,6.08107和5.10 107 #/(cm2s)。综合考虑中子准直效果及光子污染,方案三具有最优性能。为后续进行BNCT-SPECT理论和实验研究提供了基础,从而有效促进BNCT剂量准确评估方法的研究进程。     

Design and synthesis of benzodiazepine-1,2,3-triazole hybrid derivatives as selective butyrylcholinesterase inhibitors

Molecular Diversity - A new series of compounds based on benzodiazepine-1,2,3-triazole were synthesized and evaluated as cholinesterase inhibitors by Ellman’s method. The compounds proved to...     

A simple and convenient synthesis of [1,2,4]triazolo/benzimidazolo ‎quinazolinone and [1,2,4]triazolo[1,5-<Emphasis Type="Italic">a</Emphasis>]pyrimidine derivatives catalyzed by ‎DABCO-based ionic liquids

DABCO-based ionic liquids were utilized for the preparation of [1,2,4]triazolo/benzimidazolo quinazolinone and [1,2,4]triazolo[1,5-a]pyrimidine derivatives in the adequate procedures. These methods involve three-component reaction between aldehydes, β-diketones and 3-amino-1,2,4-triazole or 2-aminobenzimidazole in the presence of 1,4-disulfo-1,4-diazabicyclo[2.2.2]octane-1,4-diium chloride ([DABCO](SO₃H)₂(Cl)₂) and 1,4-disulfo-1,4-diazabicyclo[2.2.2]octane-1,4-diium dihydrogen sulfate ([DABCO](SO₃H)₂(HSO₄)₂) as reusable and economical catalysts at 100 °C. These methods also show eco-friendly characters by elimination of solvent. Any by-product was not prepared through this method, and products were separated by a simple workup procedure. The other noticeable benefits of these procedures are excellent yields, short reaction times, mild reaction conditions and use of available and inexpensive materials.     

N‐Bromosuccinimide (NBS): A Novel and Efficient Catalyst for the Synthesis of 14‐Aryl‐14H‐dibenzo[a,j]xanthenes under Solvent‐Free Conditions

A novel procedure for the synthesis of 14‐aryl‐14H‐dibenzo[a,j]xanthenes through one‐pot condensation of naphthalen‐2‐ol with arenecarbaldehydes in the presence of N‐bromosuccinimide (NBS) as catalyst under solvent‐free conditions is described.     

A novel ternary GO@SiO2‐HPW nanocomposite as an efficient heterogeneous catalyst for the synthesis of benzazoles in aqueous media

A new solid acid catalyst, consisting of 12‐phosphotungstic heteropoly acid (HPW) supported on graphene oxide/silica nanocomposite (GO@SiO₂), has been developed via immobilizing HPW onto an amine‐functionalized GO/SiO₂ surface through coordination interaction (GO@SiO₂‐HPW). The GO@SiO₂‐HPW nanocomposite was characterized by Fourier transform infrared (FT‐IR) spectroscopy, thermogravimetric analysis (TGA), scanning electron microscopy (SEM), and powder X‐ray diffraction (XRD). The prepared nanocomposite could be dispersed homogeneously in water and further used as a heterogeneous, reusable, and efficient catalyst for the synthesis of benzimidazoles and benzothiazoles by the reaction of 1,2‐phenelynediamine or 2‐aminothiophenol with different aldehydes.     

An efficient synthesis of thiazol-2-imine derivatives via a one-pot,three-component reaction

A simple and highly efficient one-pot, three-component procedure for the synthesis of thiazol-2-imines, via the reaction of aromatic α-bromoketones, primary amines, and phenyl isothiocyanate in the presence of a catalytic amount of triethylamine, is described.