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21.
Samadi Morasae Zirak Mohammad Naseri Amene Kheirabadi Malihe Ebrahimi Mahdi Moshfegh Alireza Z. 《Research on Chemical Intermediates》2019,45(4):2197-2254
Research on Chemical Intermediates - Photocatalysis using semiconductors has emerged as a promising wastewater treatment process to overcome the major challenges faced by conventional technologies.... 相似文献
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Sharif N. Akhavan Ehsani M. Zaarei D. Kalaee M. R. Khajavi R. 《Russian Journal of Applied Chemistry》2020,93(11):1765-1773
Russian Journal of Applied Chemistry - Graphene oxide as a derivative of graphite has been noticed as a high efficient material and its application in nanocomposite coatings is surprisingly... 相似文献
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Malihe Samadi Kazemi Elham Ataeei Malihe Nasrabadi 《Russian Journal of Electrochemistry》2016,52(10):975-982
The complexation reaction between Tl+, Ag+ and Pb2+ cations with 2,6-di(furyl-2yl)-4-(4-methoxy phenyl)pyridine as a new synthesis ligand in acetonitrile (ACN)–H2O and methanol (MeOH)–H2O binary solutions has been studied at different temperatures using conductometric method. The conductometric data show that the stoichiometry of the complexes is 1: 1 [M: L] and the stability constant of complexes changes with the binary solutions identity. Also, the structure of the resulting 1: 1 complexes was optimized using the LanL2dz basis set at the B3LYP level of theory using GAUSSIAN03 software. The results show that the change of logKf for (DFMP.Pb)2+ and (DFMP.Ag)+ complexes with the mole ratio of acetonitrile and for (DFMP.Ag)+ and (DFMP.Tl)+ complexes with the mole ratio of methanol have a linear behavior, while the change of logKf of (DFMP.Tl)+complex in ACN–H2O binary solutions (with a minimum in XACN = 0.5) and (DFMP.Ag)+ complex in MeOH–H2O binary solutions (with a minimum in XMeOH = 0.75) show a non-linear behavior. The selectivity order of DFMP ligand for these cations in mol % CAN = 25 and 75 obtain Tl+ > Pb2+ > Ag+ but in mol % CAN = 50, the selectivity order observe Pb2+ > Tl+ > Ag+. Also, this selectivity sequence of DFMP in MeOH–H2O (mol % MeOH = 75 and 100) and (mol % MeOH = 50) is obtained Pb2+ > Ag+ and Tl+ > Ag+ > Pb2+ respectively. The values of thermodynamic parameters show that these values are influenced by the nature and the composition of binary solution. In all cases, the resulting complexes are enthalpy stabilized and entropy destabilized. The TΔSC° versus ΔHC° plot of all obtained thermodynamic data shows a fairly good linear correlation which indicates the existence of enthalpy-entropy compensation in the complexation reactions. 相似文献
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The domino Knoevenagel hetero-Diels-Alder reaction of the O-propargylated salicylaldehydes and 4-hydroxycoumarin leads to pyrano[2,3-c]coumarins 3 and pyrano[2,3-c]chromones 4 in high yield in the presence of CuI as a Lewis acid. In all cases, the reaction was shown to exhibit high regioselectivity and form product 3 as main product. 相似文献
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Structures, binding energies, harmonic frequencies, dipole moments, HOMO–LUMO energy gaps and particularly atoms in molecules
(AIM) analyses of some nanoannular carbon clusters (C4–C20) are investigated at B3LYP/6-31+G(d) level of theory. No correlation is found by plotting the calculated binding energies
as a functional number of carbon atoms of carbon clusters. The calculated binding energies sharply increase from C4 to C10 while slowly from C10 to C20. The binding energies of C4n+2 clusters including C6, C10, C14, and C18 have a clear increase when compared with others indicating their aromatic characters which is confirmed by results of HOMO–LUMO
energy gaps and geometrical parameters. AIM analyses show that most of our carbon clusters are topologically normal (non-conflict)
with stable structures. Nevertheless, the topological networks of small antiaromatic rings, C4 and C8, at their equilibrium geometries may change via molecular vibrations. The existence of straight bond paths in 3D molecular
graphs of carbon clusters with n > 10 implies that ring strains are decreased as the ring sizes grow. Except for C4 and C8, the ellipticity values for the remaining carbon clusters are small indicating that the C–C bond is conserved in these clusters.
Dipole moments of even-numbered structures are negligible, whereas odd-numbered ones have μ values of 0.09−0.73 D. 相似文献
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We have prepared a highly selective and efficient sorbent for the simultaneous separation and preconcentration of lead and cadmium ions from milk and water samples. An ionic liquid was deposited on the surface of magnetic nanoparticles (IL-MNPs) and used for solid phase extraction of these ions. The IL-MNPs carrying the target metals were then separated from the sample solution by applying an external magnetic field. Lead and cadmium were almost quantitatively retained by the IL-MNPs, and then eluted with nitric acid. The effect of different variables on solid phase extraction was investigated. The calibration curve is linear in the range from 0.3 to 20?ng mL?1 of Cd(II), and from 5 to 330?ng mL?1 of Pb(II) in the initial solution. Under optimum conditions, the detection limits are 1.61 and 0.122?μg?L-1 for Pb(II) and Cd(II) respectively. Relative standard deviations (n?=?10) were 2.87?% and 1.45?% for 0.05?μg?mL-1 and 0.2?μg?mL-1 of Cd (II) and Pb (II) respectively. The preconcentration factor is 200 for both of ions. Figure
A novel, highly selective and efficient sorbent, was prepared and applied for separation and preconcentration of lead and cadmium from real samples. Lead and cadmium could be quantitatively retained by ionic liquid-modified magnetite nanoparticles and then easily separated from the aqueous solution by applying an external magnetic field; so, no filtration or centrifugation was necessary. 相似文献
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Malihe Javan Khoshkholgh Mohammad Reza Hosseindokht Saeed Balalaie Mohammad Reza Bozorgmehr Hamid Reza Bijanzadeh 《Helvetica chimica acta》2012,95(1):52-60
The CuI‐catalyzed intramolecular oxa‐Diels? Alder reaction of 2‐(prop‐2‐yn‐1‐yloxy)benzaldehydes as unactivated terminal alkynes with 4‐hydroxy‐6‐methyl‐2H‐pyran‐2‐one is described. The reaction proceeds with remarkable chemoselectivity to yield pyranones 3 (Scheme 1). A theoretical investigation of the reaction in terms of HOMO? LUMO interactions in the gas phase is also reported. The reaction could be regarded as an inverse‐electron‐demand Diels? Alder cycloaddition. The theoretical results are in high agreement with the experimental evidences. 相似文献
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A. Akhshani A. Akhavan S.-C. Lim Z. Hassan 《Communications in Nonlinear Science & Numerical Simulation》2012,17(12):4653-4661
The topic of quantum chaos has begun to draw increasing attention in recent years. While a satisfactory definition for it is not settled yet in order to differentiate between its classical counterparts. Dissipative quantum maps can be characterized by sensitive dependence on initial conditions, like classical maps. Considering this property, an implementation of image encryption scheme based on the quantum logistic map is proposed. The security and performance analysis of the proposed image encryption is performed using well-known methods. The results of the reliability analysis are encouraging and it can be concluded that, the proposed scheme is efficient and secure. The results of this study also suggest application of other quantum maps such as quantum standard map and quantum baker map in cryptography and other aspects of security and privacy. 相似文献