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In chemistry, polarity is a separation of electric charge leading to a molecule or its chemical groups having an electric dipole moment, with a negatively charged end and a positively charged end. Polar molecules must contain one or more polar bonds due to a difference in electronegativity between the bonded atoms.
The Taft equation is often employed in biological chemistry and medicinal chemistry for the development of quantitative structure–activity relationships (QSARs). In a recent example, Sandri and co-workers [13] have used Taft plots in studies of polar effects in the aminolysis of β-lactams.
The matrix above can be used with the molar refractivity equation and other data to produce density data for crystallography. Each polarizability measurement along with the refractive index associated with its direction will yield a direction specific density that can be used to develop an accurate three dimensional assessment of molecular ...
VLE of the mixture of chloroform and methanol plus NRTL fit and extrapolation to different pressures. The non-random two-liquid model [1] (abbreviated NRTL model) is an activity coefficient model introduced by Renon and Prausnitz in 1968 that correlates the activity coefficients of a compound with its mole fractions in the liquid phase concerned.
For example, the copolymerization of maleic anhydride and styrene has reactivity ratios = 0.01 for maleic anhydride and = 0.02 for styrene. [7] Maleic acid in fact does not homopolymerize in free radical polymerization, but will form an almost exclusively alternating copolymer with styrene.
Arrow pushing or electron pushing is a technique used to describe the progression of organic chemistry reaction mechanisms. [1] It was first developed by Sir Robert Robinson.In using arrow pushing, "curved arrows" or "curly arrows" are drawn on the structural formulae of reactants in a chemical equation to show the reaction mechanism.
The polarizable continuum model (PCM) is a commonly used method in computational chemistry to model solvation effects. When it is necessary to consider each solvent molecule as a separate molecule, the computational cost of modeling a solvent-mediated chemical reaction becomes prohibitively high.
Thus, to get current density from molar flux one needs to multiply by Faraday's constant F (Coulombs/mol). F will then cancel from the equation below. Since the valence has already been accounted for above, the charge q A of each ion in the equation above, therefore, should be interpreted as +1 or -1 depending on the polarity of the ion.