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    Solvatochromic parameters for binary mixtures of an ionic liquid with various protic molecular solvents

    , Article Monatshefte fur Chemie ; Volume 140, Issue 3 , 2009 , Pages 329-334 ; 00269247 (ISSN) Khodadadi Moghaddam, M ; Habibi Yangjeh, A ; Gholami, M. R ; Sharif University of Technology
    2009
    Abstract
    Solvatochromic parameters (E T N , normalized polarity parameter; π, dipolarity/polarizability; β, hydrogen-bond acceptor basicity; α, hydrogen-bond donor acidity) have been determined for binary mixtures of propan-2-ol, propan-1-ol, ethanol, methanol and water with recently synthesized ionic liquid (IL; 2-hydroxyethylammonium formate) at 25 °C. In all solutions except aqueous solution, E T N values of the media increase abruptly with the ILs mole fraction and then increase gradually to the value of pure IL. A synergistic behavior is observed for the α parameter in all solutions. The behavior of π and β are nearly ideal for all solutions except for solutions of methanol with the IL. The... 

    Solvent effects on the reaction rate and selectivity of synchronous heterogeneous hydrogenation of cyclohexene and acetone in ionic liquid/alcohols mixtures

    , Article Journal of Molecular Catalysis A: Chemical ; Volume 306, Issues 1–2 , July , 2009 , Pages 11–16 Khodadadi-Moghaddam, M. (Mohammad) ; Habibi-Yangjeh, A. (Aziz) ; Gholamia, M. R. (Mohamad Reza) ; Sharif University of Tecnology
    Abstract
    Synchronous heterogeneous catalytic hydrogenation of cyclohexene and acetone, catalyzed by Pt/Al2O3, was carried out in solutions of 2-hydroxy ethylammonium formate (a room temperature ionic liquid, RTIL) with ethanol and propan-1-ol at 25 °C. Rate constants and selectivity of the reaction (relative to cyclohexene hydrogenation) increase with mole fraction of the ionic liquid (IL). The reactants tendency to the catalyst surface increases by addition of the ionic liquid and thus the reaction rate increases, especially for cyclohexene hydrogenation. Consequently the selectivity to cyclohexene hydrogenation was increased. Single-parameter correlations of log kvs.π* (dipolarity/polarizibility)... 

    Molecular-microscopic properties and preferential solvation in protic ionic liquid mixtures

    , Article Journal of Solution Chemistry ; Volume 42, Issue 9 , October , 2013 , pp. 1757-1769 ; 1572-8927 Salari, H. (Hadi) ; Ahmadvand, S. (Seyedsaeid) ; Harifi-Mood, A. R. (Ali Reza) ; Padervand, M. (Mohsen) ; Gholami, M. R. (Mohammad Reza) ; Sharif University of Technology
    Abstract
    Structural and molecular-microscopic properties of the solvatochromic probes 4-nitroaniline, 4-nitroanisole, and Reichardt’s dye were investigated in binary mixtures of ethylammonium propionate with methanol, ethanol, 1-propanol and 2-propanol. Solvatochromic parameters (α, hydrogen-bond donor acidity; β, hydrogen-bond acceptor basicity; π*, dipolarity/polarizability; ENT , normalized polarity parameter) in different binary mixtures of ionic liquid with molecular solvents were determined with UV–Vis spectroscopy. The ENT parameters show nearly ideal trends in all solvent mixtures, but the other parameters show different behavior in the mixtures. The π* parameters show a negative deviation... 

    Molecular-microscopic properties and preferential solvation in protic ionic liquid mixtures

    , Article Journal of Solution Chemistry ; Volume 42, Issue 9 , 2013 , Pages 1757-1769 ; 00959782 (ISSN) Salari, H ; Ahmadvand, S ; Harifi-Mood, A. R ; Padervand, M ; Gholami, M. R ; Sharif University of Technology
    2013
    Abstract
    Structural and molecular-microscopic properties of the solvatochromic probes 4-nitroaniline, 4-nitroanisole, and Reichardt's dye were investigated in binary mixtures of ethylammonium propionate with methanol, ethanol, 1-propanol and 2-propanol. Solvatochromic parameters (α, hydrogen-bond donor acidity; β, hydrogen-bond acceptor basicity; π*, dipolarity/ polarizability; ET N, normalized polarity parameter) in different binary mixtures of ionic liquid with molecular solvents were determined with UV-Vis spectroscopy. The ET N parameters show nearly ideal trends in all solvent mixtures, but the other parameters show different behavior in the mixtures. The πparameters show a negative deviation... 

    Kinetic study of heterogeneous catalytic hydrogenation of cyclohexene to cyclohexane in ionic liquid-alcohols mixtures

    , Article Applied Catalysis A: General ; Volume 341, Issue 1-2 , 2008 , Pages 58-64 ; 0926860X (ISSN) Khodadadi Moghaddam, M ; Habibi Yangjeh, A ; Gholami, M. R ; Sharif University of Technology
    2008
    Abstract
    Heterogeneous catalytic hydrogenation of cyclohexene, catalyzed by Pt/Al2O3, was carried out in solutions of 2-hydroxyethylammonium formate (a room temperature ionic liquid, RTIL) mixed with methanol, ethanol and propan-2-ol at 25 °C. The rate constants of the reaction in ionic liquid alcohol mixtures were higher than alcohol alone. First-order rate constant of the reaction in the RTIL relative to propan-2-ol is approximately 28. Furthermore, the rate constant of the reaction increases with the mole fraction of the ionic liquid. Single-parameter correlations of log k vs. normalized polarity parameter (ETN), hydrogen-bond acceptor basicity (β) and hydrogen-bond donor acidity (α) do not give... 

    Solvatochromic parameters for binary mixtures of 1-(1-butyl)-3- methylimidazolium tetrafluoroborate with some protic molecular solvents

    , Article Journal of Physical Chemistry B ; Volume 110, Issue 13 , 2006 , Pages 7073-7078 ; 15206106 (ISSN) Harifi Mood, A. R ; Habibi-Yangjeh, A ; Gholami, M. R ; Sharif University of Technology
    American Chemical Society  2006
    Abstract
    The solvatochromic parameters (ETN, normalized polarity parameter; π*, dipolarity/polarizability; β, hydrogen-bond acceptor basicity; α, hydrogen-bond donor acidity) were determined for binary solvent mixtures of 1-(1-butyl)-3-methylimidazolium tetrafluoroborate ([bmim]BF4) with water, methanol, and ethanol at 25°C over the whole range of mole fractions. In nonaqueous solutions, the ETN value of the mixture increases with mole the fraction of [bmim]BF4 and then decreases gradually to the value of pure [bmim]BF4. Positive deviation from ideal behavior was observed for the solvent parameters ETN, π*, and α, whereas the deviation of the β parameter is negative. The applicability of the combined... 

    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 the reaction rate and selectivity of synchronous heterogeneous hydrogenation of cyclohexene and acetone in ionic liquid/alcohols mixtures

    , Article Journal of Molecular Catalysis A: Chemical ; Volume 306, Issue 1-2 , 2009 , Pages 11-16 ; 13811169 (ISSN) Khodadadi Moghaddam, M ; Habibi Yangjeh, A ; Gholami, M. R ; Sharif University of Technology
    2009
    Abstract
    Synchronous heterogeneous catalytic hydrogenation of cyclohexene and acetone, catalyzed by Pt/Al2O3, was carried out in solutions of 2-hydroxy ethylammonium formate (a room temperature ionic liquid, RTIL) with ethanol and propan-1-ol at 25 °C. Rate constants and selectivity of the reaction (relative to cyclohexene hydrogenation) increase with mole fraction of the ionic liquid (IL). The reactants tendency to the catalyst surface increases by addition of the ionic liquid and thus the reaction rate increases, especially for cyclohexene hydrogenation. Consequently the selectivity to cyclohexene hydrogenation was increased. Single-parameter correlations of log k vs. π* (dipolarity/polarizibility)... 

    Preferential solvation and behavior of solvatochromic indicators in mixtures of an ionic liquid with some molecular solvents

    , Article The Journal of Physical Chemistry B ; vol.114 (29) , July , 2010 , pp 9586–9593 Salari, H. (Hadi) ; Khodadadi-Moghaddam, M.(Mohammad) ; Harifi-Mood, A. R. (Ali Reza) ; Gholami, M. R. (Mohammad Reza) ; Sharif University of Technology
    Abstract
    Structural and intermolecular interactions of solvatochromic probes 4-nitroaniline, 4-nitroanisole, and Reichardt’s dye were investigated in the binary mixtures of 2-hydroxy ethylammonium formate as an ionic liquid with N,N-dimethyl formamide, dimethyl amine, and dimethyl sulfoxide. Solvatochromic parameters (ETN, normalized polarity parameter; π*, dipolarity/polarizability; β, hydrogen-bond acceptor basicity; α, hydrogen -bond donor acidity) were determined in ionic liquid mixtures at 25 °C using UV−vis spectroscopy. ETN parameters obtained from absorbance of Reichardt’s dye within various mixtures of ionic liquid were observed to be higher than predicted values from ideal additive... 

    Preferential solvation and behavior of solvatochromic indicators in mixtures of an ionic liquid with some molecular solvents

    , Article Journal of Physical Chemistry B ; Volume 114, Issue 29 , 2010 , Pages 9586-9593 ; 15206106 (ISSN) Salari, H ; Khodadadi Moghaddam, M ; Harifi Mood, A. R ; Gholami, M. R ; Sharif University of Technology
    American Chemical Society  2010
    Abstract
    Structural and intermolecular interactions of solvatochromic probes 4-nitroaniline, 4-nitroanisole, and Reichardts dye were investigated in the binary mixtures of 2-hydroxy ethylammonium formate as an ionic liquid with N,N-dimethyl formamide, dimethyl amine, and dimethyl sulfoxide. Solvatochromic parameters (ETN, normalized polarity parameter; π, dipolarity/polarizability; β, hydrogen-bond acceptor basicity; α, hydrogen -bond donor acidity) were determined in ionic liquid mixtures at 25°C using UV-vis spectroscopy. ETN parameters obtained from absorbance of Reichardt dye within various mixtures of ionic liquid were observed to be higher than predicted values from ideal additive behavior.... 

    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...