Some heterobimetallic ion-pair complexes of Ni(II) with Mn(II), Co(II) and , Zn (II) using 1,10-phenanthroline (phen) and 1-tert-butylimidazole-2-thione (tm) ligands were prepared by co-crystallization of Ni(II)-phen cationic complex and Cl / tm containing anionic complex in acetonitrile / methanol solvent. The [Ni(phen)3][MnCl4] (1) contains two molecule of acetonitrile and [Ni(phen)3] 2+ is h...

The crystal structures of mono- and diperiodic lead(II) complexes with Kemp’s tricarboxylate are searched for possible effects the lone pair, particularly through Pb⋅⋅⋅H interactions. triacid (H 3 kta; cis,cis- 1,3,5-trimethylcyclohexane-1,3,5-tricarboxylic acid) has been used to synthesize three under solvo-hydrothermal conditions. [Pb (kta)Cl ] ( 1 ) kta)(kta) 2 both coordination polymers dis...

The formation of charge-transfer complexation between dibenzo-15-crown-5 (DB15C5) and benzo-12-crown-4 (B12C4) (Donor) and iodine is investigated spectrophotometrically in three chlorinated solvents,chloroform, dichloromethane (DCM) and 1,2-dichloroethane (DCE) solution at 25°C. The change in polarityof the solvent also doesn’t affect the stoichiometry of the complexes. Values of formation cons...

A theoretical investigation associated with obliquely propagating ion-acoustic shock waves (IASHWs) in a three-component magnetized plasma having inertialess non-extensive electrons, inertial warm positive and negative ions has been performed. Burgers equation is derived by employing the reductive perturbation method. Our model supports both structures under consideration of electrons. It found...

The computer simulation program of a practical scale reverse electrodialysis process has been developed based on the program for saline water electrodialysis. The program is applied to compute the performance of an industrial-scale reverse electrodialysis stack (effective membrane area S = 1 m × 1 m = 1 m2, cell pair number N = 300 pairs). The stack operatingconditions are optimized. Seaw...

We have investigated the solvation shell dynamics of Na and Cl ion pairs in water DMSO mixtures of three compositions with xDMSO (mole fraction of DMSO) = 0.21, 0.35 and 0.48. Dynamical ion pair trajectories in these compositions are studied to analyze the diffusional behaviour of the solvent molecules in the primary and secondary solvation shells as well as the bulk solvent. As expected, the d...

The interaction between hydronium ion and several crown ethers was studied via conductometry in nitromethane at 25 °C and 1H-NMR techniques. The stabilities of the resulting 1:1 complexes were determined from the conductance data and found to vary in the order DC18C6 > 18C6 > DB30C10 > DB24C8 > DB18C6 > ~B15C5 > DB21C7. For the first time, evidences for the formation of a 2:1 san...

The effects of solvation and entropy play a critical role in determining the binding free energy in protein-ligand interactions. Despite the good balance between speed and accuracy, no current knowledge-based scoring functions account for the effects of solvation and configurational entropy explicitly due to the difficulty in deriving the corresponding pair potentials and the resulting double c...