Importance of weak interactions in developing 1,3-bis(4,6-dimethyl-1H-nicotinonitrile-1-yl)1,3-dioxy propane polymorphs

The structure of 1,3-bis(4,6-dimethyl-1H-nicotinonitrile-1-yl)1,3-dioxy propane polymorphs has been characterized by X-ray diffraction, FT-IR, 1H and 13C NMR spectroscopies. The influence of intra and intermolecular weak interactions is thoroughly studied in solid state using single crystal X-ray diffraction and FT-IR. These polymorphs belong to monoclinic space group 'P2(1/n)' and 'P2(1/c)'. These polymorphs have C-H?n (lone pair), hydrogen bonds, C-N?π, C-H?π and π?π intermolecular non-covalent interactions. These polymorphs are the result of weak interactions and solvent used in crystallization. The FT-IR spectra have been recorded in the solid phase and NMR has been recorded in solvent. The optimized geometry has been calculated by B3LYP methods using different basis sets. The FT-IR and NMR spectra of 1st polymorphs has been calculated at B3LYP/6-31G (d) level. The scaled theoretical wave number showed good agreement with the experimental values. These two polymorphs as well as other stereomers are studied by DFT calculations.     

Untersuchungen über die Chelate einiger seltenerer Übergangsmetalle,I. Mitt: Ir(III), Pt(IV) und Au(III)

Chelates of bidentate ligands, p-dimethylamino and p-diethylaminoanils of 3-benzoylmethylglyoxal with Ir(III), Pt(IV) and Au(III) ions have been studied for their stoichiometry, electrolytic nature, infrared, magnetic, and electronic spectra. In addition to the elucidation of stereochemistry and structures various ligand field parameters have been calculated and unusual paramagnetic behaviour has been accounted for.     

Platinum(IV) complexes of reducing sugars in an alkaline medium and their resistance to reaction with N-bromosuccinimide. A kinetic study

Spectrophotometric studies support the formation of { Pt^IV–S} (where S = glucose, galactose and fructose) complexes in an alkaline medium. The resistance of these complexes to reaction with N-bromosuccinimide (NBS) has been observed. The kinetic data also support the formation of { Pt^IV –S} complexes.     

Sum rules and their application to surface tension

Sum rules for inhomogeneous fluids are derived and then related to the surface tension of a liquid—vapor interface. It is found that this surface tension can be expressed in terms of the static correlation for the component of force normal to the interface. This formula is shown to be equivalent to two previous expressions for surface tension that generally are regarded as being exact. It is demonstrated that in the high-frequency or short-time limit this definition for surface tension leads directly to the standard hydrodynamic equation of motion for the normal component of the interfacial velocity.     

Absolute matrix summability of a factored Fourier series

A theorem for a factored Fourier series is proved.     

Statistical mechanics of a nonlinear stochastic model

A multivariable Fokker-Planck equation (FPE) is used to investigate the equilibrium and dynamical properties of a nonlinear stochastic model. The model displays a phase transition. The equilibrium distributions are found to be non-Gaussian; the deviation from Gaussian is especially significant near the transition point. To study the nonequilibrium behavior of the model, a self-consistent dynamic mean field (SCDMF) theory is derived and used to transform the FPE to a systematic hierarchy of equations for the cumulant moments of the time-dependent distribution function. These equations are numerically solved for a variety of initial conditions. During the time evolution of the system from an initial unstable equilibrium state to the final equilibrium state, three distinct time stages are found.Supported by a grant from the National Research Council of Canada (to RCD) and by the Sherman Fairchild Foundation (to RZ).Also Sherman Fairchild Distinguished Scholar, 1974–75, at the California Institute of Technology, where the early part of this research was done.     

Nanocomposite of bimetallic nanodendrite and reduced graphene oxide as a novel platform for molecular imprinting technology

In this present work, for the first time, we are reporting a green synthesis approach for the preparation of vinyl modified reduced graphene oxide-based magnetic and bimetallic (Fe/Ag) nanodendrite (RGO@BMNDs). Herein, the RGO@BMNDs acts as a platform for the synthesis of the pyrazinamide (PZA)-imprinted polymer matrix and used for designing of the electrochemical sensor. We have demonstrated how the change in morphology could affect the electrochemical and magnetic property of nanomaterials and for this the reduced graphene oxide-based bimetallic nanoparticle (Fe/Ag) was also prepared It was found that the combination of graphene and bimetallic nanodendrites shows improvement as well as enhancement in the electrocatalytic activity and adsorption capacity, in comparison to their respective nanoparticles. The application of imprinted-RGO@BMNDs sensor was explored for trace level detection of PZA (Limit of detection = 6.65 pg L⁻¹, S/N = 3), which is a drug used for the cure of Tuberculosis. This is lowest detection limit reported so far for the detection of PZA. The sensor is highly selective, cost-effective, simple and free from any interfering effect. The real time application of the sensor was explored by successful detection of PZA in pharmaceutical and human blood serum, plasma and urine samples.