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71.
Intermolecular stacking in pyrazolo[3,4‐d]pyrimidine‐based pentamethylene‐linked flexible molecules
Kamlakar Avasthi Sheikh M. Farooq Ashish K. Tewari Ashoke Sharon Prakas R. Maulik 《Acta Crystallographica. Section C, Structural Chemistry》2003,59(1):o42-o45
The crystal structures of 1‐{5‐[4,6‐bis(methylsulfanyl)‐2H‐pyrazolo[3,4‐d]pyrimidin‐2‐yl]pentyl}‐6‐methylsulfanyl‐4‐(pyrrolidin‐1‐yl)‐1H‐pyrazolo[3,4‐d]pyrimidine, C22H29N9S3, and 6‐methylsulfanyl‐1‐{5‐[6‐methylsulfanyl‐4‐(pyrrolidin‐1‐yl)‐2H‐pyrazolo[3,4‐d]pyrimidin‐2‐yl]pentyl}‐4‐(pyrrolidin‐1‐yl)‐1H‐pyrazolo[3,4‐d]pyrimidine, C25H34N10S2, which differ in having either a pyrrolidine substituent or a methylsulfanyl group, show intermolecular stacking due to aromatic π–π interactions between the pyrazolo[3,4‐d]pyrimidine rings. 相似文献
72.
Vannessa Lawai Zainab Ngaini Saba Farooq Rafeah Wahi Showkat Ahmad Bhawani 《先进技术聚合物》2024,35(2):e6317
Molecularly imprinted polymer (MIP) has gained wide interest among researchers due to its unique molecular recognition of the template that is suitable as a drug carrier. Therefore, the preparation and formulation of the MIP are significant to suit the needs of the intended use. Due to its significance in drug delivery, this review aims to highlight various methods in the preparation of MIP, the composition for both controlled and stimuli-responsive drug delivery systems, and the release mechanism of the drugs. In drug delivery systems, MIP should have a sustained release performance as well as flexibility in surface modification for targeted delivery via a range of stimuli-responses, including external stimuli (magnetic, light) and internal stimuli (pH, temperature, redox, biological). The properties of sustained release and targeted delivery of the MIP can improve the drug's therapeutic efficacy as well as the breakthrough for the tumor targeting application. 相似文献
73.
This article scrutinizes the features of viscous dissipation in the stagnation point flow past through a linearly stretched Riga wall by implementing Cattaneo-Christov heat flux model. Viscous dissipation is carried out in Cattaneo-Christov diffusion analysis for the first time in this letter. As a result of Cattaneo-Christov model, some extra terms of viscous dissipation are appeared in the energy equation. These extra terms of viscous dissipation are missing in the literature. On the utilization of suitable transformations, the equations governing the problem are reduced under the boundary layer approximation into the non-linear and dimensionless ordinary differential equations. Convergent approach is utilized to solve the dimensionless governing equations. The solution thus acquired is used to highlight the effects of emerging parameters on velocity distribution and fluid's temperature through the graphs. Features of the drag force (or skin friction co-efficient) are graphically interpreted. It is noticed that the presence of modified Hartman number helps to reduce the fluid's temperature but enhances the velocity profile. Further an enlargement in the value of thermal time relaxation parameter helps to decrease the temperature distribution. 相似文献
74.
Mubasher Jamil M. Umar Farooq Muneer Ahmad Rashid 《The European Physical Journal C - Particles and Fields》2009,61(3):471-476
In this paper, the model of the holographic Chaplygin gas has been extended to two general cases: first the case of a modified
variable Chaplygin gas and second the case of the viscous generalized Chaplygin gas. The dynamics of the model is expressed
by the use of scalar fields and scalar potentials. 相似文献
75.
Reaction of imidazole derivatives with 2,3-di(bromomethyl)pyrazine results in the formation of the new pyrazine-bridged diimidazolium salts 1-8. These salts proved to be valuable precursors for dinuclear complexes with mixed NHC/pyrazine ligands. Two of the pyrazine-bridged diimidazolium salts 3·H2O and 8·2H2O have been characterized by X-ray diffraction. Furthermore, the first catalytic studies with mixtures of palladium acetate and the imidazolium salts have been carried out. The in situ prepared palladium complexes derived from the diimidazolium salts 1-8 exhibit a modest catalytic activity in Heck-type coupling reactions between 4-bromo benzaldehyde and styrene or n-butyl acrylate. 相似文献
76.
A three-dimensional mathematical model is developed to examine the flow of nonlinear thermal radiation Oldroyd-B nanofluid past a bidirectional linearly stretched surface in a porous medium. The flow is induced by temperature dependent thermal conductivity, chemical reaction and convective heat and mass conditions. Novel characteristics of Brownian motion and thermophoresis are accompanied by magnetohydrodynamic and heat generation/absorption. Self-similar transformations are employed to convert the system of nonlinear partial differential equations to a system of ordinary differential equations with high nonlinearity and are solved by strong analytic technique named as Homotopy Analysis method (HAM). Effects of varied arising parameters on involved distributions are reflected through graphical illustrations. From this study, it is perceived that strong magnetic field hinders the fluid's motion and leads to rise in temperature that eventually lowers heat transfer rate from the surface. Further, decrease in heat transfer rate is also observed for enhanced values of thermal radiation parameter. To validate our results, a comparison with already published paper in limiting case is also given and results are found in excellent oncurrence; hence reliable results are being presented. 相似文献
77.
Parallel propagating modes and anomalous spatial damping in the ultra-relativistic electron plasma with arbitrary degeneracy
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The dispersion relations of parallel propagating modes(Langmuir mode, right and left handed circular polarized waves) in the weak magnetic field limit |ω-k·v| ? are considered for ultra-relativistic arbitrary degenerate electron plasma. The results are presented in terms of moments of Fermi-Dirac distribution. The increase in the electron equilibrium number density from negative large(weakly degenerate) to positive large(highly degenerate) values of μ/T_e is observed(where μ is the electron chemical potential and T_e is the electron thermal energy). As a result, shifting of the cutoff points in all the real dispersion branches towards the higher values and increasing in the band gap between unmagnetized longitudinal and transverse modes in k-space are examined. Also, the suppression of the weak magnetic field effects in weakly magnetized right handed and left handed circular polarized waves and a decrease in the longitudinal and transverse screening effects are observed in the graphical patterns due to an increase in the equilibrium number density. 相似文献
78.
Wajid Hussain Muhammad Shahid Iqbal Hui Li Muhammad Sulaman Honglian Guo Chuanbo Li Yahya Sandali Ahmad Irfan Hafiz Saqib Ali 《International journal of quantum chemistry》2024,124(1):e27223
Perylene diimide (PDI) and naphthalene diimides (NDIs) are compounds widely used in supramolecular structures due to their versatile and functional properties. They have high absorptions and photoluminescence capabilities, which make them ideal for electronic transition studies. Reflux method, a widely employed synthetic technique, was utilized to synthesize NDI and PDI derivatives. In this method, the respective amino acids and NTDA (naphthalene-1,4,5,8-tetracarboxylic dianhydride) were combined in acetic acid and the resulting mixture was subjected to reflux. This study centered on a diverse set of NDI and PDI ligands, comprising L-ala-NDI, B-ala-NDI, Gly-NDI, Imi-NDI, Pyr-NDI, L-ala-PDI, B-ala-PDI, Gly-PDI, Imi-PDI, and Pyr-PDI ligands. Crystal structures were obtained for three NDI ligands, while the characterization of all ligands involved several analytical techniques such as NMR, IR, UV, DFT, TD-DFT calculations, and single-crystal x-ray crystallography specifically for the NDI ligands. The investigation focused on studying the electron acceptor/donor behavior of the NDI and PDI ligands, identifying their potential for charge transfer applications. Furthermore, the NLO (nonlinear optical) response of all 10 NDI and PDI ligands was assessed through an analysis involving HOMO-LUMO, TDM, EDDM, NCI, Iso-surface, MEP, natural population, and DOS analysis. This evaluation encompassed the examination of linear polarizability, as well as first and second hyperpolarizability in the context of NLO. The findings of the study revealed that Gly-PDI, Imi-PDI, L-ala-PDI, and B-ala-PDI ligands displayed a higher NLO response compared with the other ligands. These results highlight the potential of these ligands for nonlinear optical applications. The comprehensive characterization and assessment of the NDI and PDI ligands contribute to a deeper understanding of their electron properties, positioning them as promising candidates for charge transfer and nonlinear optical materials. 相似文献
79.
Sajid ZI Anwar F Shabir G Rasul G Alkharfy KM Gilani AH 《Molecules (Basel, Switzerland)》2012,17(4):3917-3932
This study appraises the antioxidant and antimicrobial attributes of various solvent extracts (absolute methanol, aqueous methanol, absolute ethanol, aqueous ethanol, absolute acetone, aqueous acetone, and deionized water) from bark, leaves and seeds of Pongamia pinnata (L.) Pierre. Maximum extraction yield of antioxidant components from bark (16.31%), leaves (11.42%) and seeds (21.51%) of P. pinnata was obtained using aqueous methanol (20:80). Of the extracts tested, the bark extract, obtained with aqueous methanol, exhibited greater levels of total phenolics [6.94 g GAE/100 g dry weight (DW)], total flavonoids (3.44 g CE/100 g DW), inhibition of linoleic acid peroxidation (69.23%) and DPPH radical scavenging activity (IC(50) value, 3.21 μg/mL), followed by leaves and seeds extracts. Bark extract tested against a set of bacterial and fungal strains also revealed the strongest antimicrobial activity with the largest inhibition zone and lowest minimum inhibitory concentration (MIC). HPLC analysis of aqueous methanol extracts from bark, leaves and seeds indicated the presence of protocatechuic, ellagic, ferulic, gallic, gentisic, 4-hydroxybenzoic and 4-hydroxycinnamic acids in bark (1.50-6.70 mg/100 g DW); sorbic, ferulic, gallic, salicylic and p-coumaric acids in leaves (1.18-4.71 mg/100 g DW); vanillic, gallic and tannic acids in seeds (0.52-0.65 mg/100 g DW) as the main phenolic acids. The present investigation concludes that the tested parts of P. pinnata, in particular the bark, have strong potential for the isolation of antioxidant and antimicrobial agents for functional food and pharmaceutical uses. 相似文献
80.
ChemInform is a weekly Abstracting Service, delivering concise information at a glance that was extracted from about 200 leading journals. To access a ChemInform Abstract, please click on HTML or PDF. 相似文献