Optical rectification coefficient in an oxide quantum dot with different confinement potentials

Exciton binding energies, oscillator strength, optical rectification coefficients and second harmonic generation are investigated using three different confinement potentials in a CdO/ZnO core/shell quantum dot. The bare potential, Smorodinsky–Winternitz potential and Woods–Saxon potential are employed in the Hamiltonian. The position dependent dielectric function is used. The electronic properties are found using variational formulism within a single band effective mass approximation whereas the optic properties are investigated using compact density matrix approach. The results show that different confinement potentials lead to significant changes in the coefficients of optical rectification and the second harmonic generations and the effects of confined potentials are more pronounced in the strong confinement region. The resonant peaks in the nonlinear optical rectification coefficients and second harmonic generation are blue shifted to larger photon energies with the various confined potentials and the results are enhanced using Smorodinsky–Winternitz potential. The obtained results can be applied for the potential applications for fabricating opto-electronic devices.     

Enhanced photocatalytic activity of Cu-doped ZnO nanorods

Cu-doped ZnO nanorods with different Cu concentrations were synthesized through the vapor transport method. The synthesized nanorods were characterized by X-ray diffraction (XRD), field emission scanning electron microscopy (FE-SEM) and UV–vis spectroscopy. The XRD results revealed that Cu was successfully doped into ZnO lattice. The FE-SEM images showed that the undoped ZnO has needle like morphology whereas Cu-doped ZnO samples have rod like morphology with an average diameter and length of 60–90 nm and 1.5–3 μm respectively. The red shift in band edge absorption peak in UV-vis absorbance spectrum with increasing Cu content also confirm the doping of Cu in ZnO nanorods. The photocatalytic activity of pure and Cu-doped ZnO samples was studied by the photodegradation of resazurin (Rz) dye. Both pure ZnO and the Cu-doped ZnO nanorods effectively removed the Rz in a short time. This photodegradation of Rz followed the pseudo-first-order reaction kinetics. ZnO nanorods with increasing Cu doping exhibit enhanced photocatalytic activity. The pseudo-first-order reaction rate constant for 15 % Cu-doped ZnO is equal to 10.17×10^?2min^?1 about double of that with pure ZnO. The increased photocatalytic activity of Cu-doped ZnO is attributed to intrinsic oxygen vacancies due to high surface to volume ratio in nanorods and extrinsic defect due to Cu doping.     

Highly chemoselective palladium-catalyzed Sonogashira coupling of 5-iodouridine-5′-triphosphates with propargylamine: a new efficient method for the synthesis of 5-aminopropargyl-uridine-5′-triphosphates

An efficient palladium-catalyzed Sonogashira coupling of 5-iodouridine-5′-triphosphates with propargylamine is described. The catalytic reaction is highly chemoselective that affords exclusively 5-aminopropargyl-uridine-5′-triphosphates in good yields with high purities (>99.8%).     

SYNTHESIS,NMR AND MOLECULAR MODELING STUDY OF 4,9a-DIARYL-9,9a-DIHYDRO 1H-[1,4]THIAZINO[4,3-a][1,3]BENZIMIDAZOLES

A series of substituted 4,9a-diaryl-9,9a-dihydro-1H-[1,4]thiazino[4,3-a][1,3]benzimidazoles was prepared in good yields from the reaction of bis(aroylmethyl) sulfides with ortho-phenylenediamine in glacial acetic acid under reflux and under microwave irradiation. Microwave irradiation is found to accelerate the reaction, besides giving better yield in the case of the thiazinobenzimidazoles with electron-withdrawing groups in the aryl rings than the thermal reaction.     

DIASTEREOSELECTIVE SYNTHESIS AND STEREOCHEMISTRY OF (Z)-1-[3-ARYL-2-(PHENYLSULFANYL)-2-OXIRANYL]-1-ETHANONES

Diastereoselective synthesis of a series of (Z)-1-[3-aryl-2-(phenylsulfanyl)-2-oxiranyl]-1-ethanones was effected from the reaction of (Z)-4-aryl-3-(phenylsulfanyl)-3-buten-2-ones with alkaline hydrogen peroxide in tetrahydrofuran. The stereochemistry of the oxiranes has been deduced from two-dimensional NOESY spectrum.     

Synthesis of Fused Tricyclic Systems from Cycloalkadienones via Diels–Alder Reaction: Sharpless Oxidation of bis Adducts

The Diels–Alder reaction between 2,7‐cyclooctadienone and cyclopentadiene goes to completion to produce a bis adduct and mono adduct under InCl₃ conditions. 2,6‐Cycloheptadienone undergoes sequential Diels–Alder reactions in the presence of AlCl₃ with cyclohexadiene and cyclopentadiene to produce the bis adduct. The bis adducts were oxidatively cleaved to produce the [5.8.5] and [5.7.6] tricyclic systems.     

Immobilization of Ru(III) complex on silica: a heterogenized catalyst for selective oxidation of alcohols in water at room temperature

We have developed a heterogenized catalyst (‘SiO₂’–NH₂–Ru^III) by the immobilization of [Ru(acac)₂(CH₃CN)₂]PF₆ on SiO₂. The catalyst was characterized by SEM, solid state NMR, EPR, FT-IR, ICP, and BET surface area analyses. ‘SiO₂’–NH₂–Ru^III catalyzed the selective oxidation of alcohols with periodic acid in water at room temperature. This protocol was applicable to the controlled oxidation of structurally diverse primary and secondary alcohols. The catalyst could be quantitatively recovered and reused up to six cycles without significant loss of catalytic activity.     

Strategies for Enhancing the Production of Penicillin G Acylase from Bacillus badius: Influence of Phenyl Acetic Acid Dosage

Bacillus badius isolated from soil has been identified as potential producer of penicillin G acylase (PGA). In the present study, batch experiments performed at optimized inoculum size, temperature, pH, and agitation yielded a maximum PGA of 9.5 U/ml in shake flask. The experiments conducted in bioreactor with different oxygen flow rates revealed that 0.66 vvm oxygen flow rate could be sufficient for the maximum PGA activity of 12.7 U/ml. From a detailed investigation on the strategies of the addition of phenyl acetic acid (PAA) for increasing the production of PGA, it was found that the controlled addition of 10 ml of 0.1 % (w/v) PAA once in every 2 h from 6th hour of growth showed the maximum PGA activity of 32 U/ml. Thus, our studies for the first time showed that at concentration above 0.1 % (w/v) PAA, the PGA production decreased. This selective condition paves the way for less costly bioprocess for the production of PGA.     

Metal‐Free Triplet Phosphors with High Emission Efficiency and High Tunability

Design of highly efficient phosphorescent emitters based on metal‐ and heavy atom‐free boron compounds has been demonstrated by taking advantage of the singlet fission process. The combination of a suitable molecular scaffold and appropriate electronic nature of the substituents has been utilized to tailor the phosphorescence emission properties in solution, neat solid, and in doped PMMA thin films.