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    Surfactant binary systems: Ab initio calculations, preferential solvation, and investigation of solvatochromic parameters

    , Article Journal of Chemical and Engineering Data ; Volume 61, Issue 1 , 2016 , Pages 255-263 ; 00219568 (ISSN) Kohantorabi, M ; Salari, H ; Fakhraee, M ; Gholami, M.R ; Sharif University of Technology
    American Chemical Society 
    Abstract
    Solvatochromic UV-vis shifts of three probes 4-nitroaniline, 4-nitroanisol, and Reichardt's dye in binary mixtures of polyethylene glycol p-(1,1,3,3-tetramethylbutyl)-phenyl ether (Triton X-100 or TX-100) with methanol, ethanol, 1-propanol, and water have been investigated at 298 K. Structural and intermolecular interactions of solvatochromic probes were determined in these systems. Solvatochromic parameters, including normalized polarity (ETN), dipolarity-polarizability (π∗), hydrogen-bond donor (α), and hydrogen-bond acceptor (β) abilities, were measured at a wide range of mole fraction (0 ≤ X ≤ 1) with 0.1 increment. Interestingly, a similar behavior of ETN and α is observed in... 

    Solvent effects on kinetics of an heteroatomic nucleophilic substitution reaction in ionic liquid and molecular solvents mixtures

    , Article Russian Journal of Physical Chemistry A ; Volume 87, Issue 12 , 2013 , Pages 1969-1975 ; 00360244 (ISSN) Salari, H ; Pedervand, M ; Sadeghzadeh Darabi, F ; Gholami, M. R ; Sharif University of Technology
    2013
    Abstract
    Rate constants, k A, for the aromatic nucleophilic substitution reaction of 2-chloro-3,5-dinitropyridine with aniline were determined in different compositions of 2-propanol mixed with hexane, benzene, and 2-methylpropan-2-ol and 1-ethyl-3-methylimidazolium ethylsulfate ([Emim][EtSO4]) with dimethyl sulfoxide at 25 C. The obtained rate constants of the reaction in pure solvents are in the following order: 2-methylpropan-2-ol > dimethyl sulfoxide > 2-propanol > hexane > benzene > [Emim][EtSO4]. Molecularmicroscopic solvent parameters corresponding to the selected binary mixtures were utilized to study the kinetics of a nucleophilic substitution reaction in order to investigate and compare the... 

    Probing solvent-solvent and solute-solvent interactions in surfactant binary mixtures: Solvatochromic parameters, preferential solvation, and quantum theory of atoms in molecules analysis

    , Article RSC Advances ; Volume 6, Issue 22 , 2016 , Pages 18515-18524 ; 20462069 (ISSN) Kohantorabi, M ; Fakhraee, M ; Salari, H ; Gholami, M. R ; Sharif University of Technology
    Royal Society of Chemistry 
    Abstract
    The behaviour of solvatochromic absorbance probes (4-nitroaniline, 4-nitroanisole, and Reichardt's dye) within binary mixtures of polyethylene glycol p-(1,1,3,3-tetramethylbutyl)-phenyl ether (Triton X-100 or TX-100)/organic solvents (2-propanol, hexanol, butyl acetate, THF, toluene, and p-xylene) was extensively explored by using solvatochromism and the quantum theory of atoms in molecules (QTAIM). To be more precise, the polarity parameters, ET N, and Kamlet-Taft parameters, such as the hydrogen bond donor ability (HBD) (α), hydrogen bond acceptor ability (HBA) (β), and dipolarity/polarizability (π∗), have been investigated in selected mixtures at 298 K. All binary mixtures exhibit complex... 

    Supported PtxPd1-x bimetallic nanoparticles on ionic liquid-functionalized SiO2@graphene oxide nanocomposite and its application as an effective multiphasic catalyst

    , Article Applied Catalysis A: General ; Volume 579 , 2019 , Pages 30-43 ; 0926860X (ISSN) Kohantorabi, M ; Giannakis, S ; Gholami, M. R ; Sharif University of Technology
    Elsevier B.V  2019
    Abstract
    In this work, PtxPd1-x (x = 0, 0.5, and 1)nanoparticles (NPs)were synthesized on the surface of SiO2@graphene oxide which covered by 1-butyl-3-methylimidazolium hexafluorophosphate ([bmim]PF6)ionic liquid (IL)layer. FT-IR spectroscopy, zeta potential, CHN elemental analysis, XRD, XPS, SEM, EDX, TEM, TGA, BET, and ICP-AES techniques were applied for the characterization of the multiphasic catalyst. The as-prepared nanocomposite was used as an effective heterogeneous catalyst for the oxidation of cyclohexene by molecular oxygen, as a green oxidant. Different experimental conditions such as oxygen pressure, reaction time, reaction temperature and amount of catalyst were investigated in this...