Synthesis, spectral characterization and eukaryotic DNA degradation of thiosemicarbazones and their platinum(IV) complexes

The condensation products of acetophenone (or its derivatives), salicylaldehyde and o-hydroxy-p-methoxybenzophenone with thiosemicarbazide and ethyl- or phenyl-thiosemicarbazide are the investigated thiosemicarbazones. Their reactions with H(2)PtCl(6) produced Pt(IV) complexes characterized by elemental, thermal, mass, IR and electronic spectral studies. The coordination modes were found mononegative bidentate in the acetophenone derivatives and binegative tridentate in the salicylaldehyde derivatives. The complexes were analyzed thermogravimetrically and found highly stable. Some ligands and their complexes were screened against Sarcina sp. and E. coli using the cup-diffusion technique. [Pt(oHAT)(OH)Cl] shows higher activity against E. coli than the other compounds. The degradation power of the tested compounds on the calf thymus DNA supports their selectivity against bacteria and not against the human or related eukaryotic organisms.     

Kinetics of aquation of chloropentamminecobalt(III) perchlorate in ethylene glycol-water media

Summary The aquation of chloropentamminecobalt(III) ion has been studied in ethylene glycol-water mixtures up to 80% by weight at five temperatures from 35 to 55°C. Specific solvent effects on the reaction rate and mechanism have been investigated and discussed. The validity of our previously proposed equations, correlating the specific reaction rate with the dielectric constant of the medium has been examined. The thermodynamic parameters of activation have been calculated and presented as evidence for the solvation effects and in support of the proposed reaction mechanism.     

Structure and conductivity investigations of alkaline earth substituted uranium oxide,U1 − xMxO2 ± δ (M = Mg,Ca, Sr) for solid oxide fuel cell applications

Alkaline earth substituted UO₂ (U_1 − xM_xO_2 ± δ; M = Mg, Ca, Sr; 0.1 ≤ x ≤ 0.525) with fluorite structure was synthesized in reducing atmosphere. Structure and conductivity properties of U_1 − xM_xO_2 ± δ fluorites were investigated for possible application in solid oxide fuel cells (SOFC). At room temperature and ambient atmosphere the materials are stable; however they decompose at an oxygen partial pressure p_O2 > 10^− 4 atm and temperatures higher than 600 °C. The total conductivity measured for the best conducting U_1 − xM_xO_2 ± δ material with M = Ca and x = 0.177 is as high as 3 S/cm at p_O2 < 10^− 4 atm at 600 °C. The relatively low ionic transference number (t_i∼0.02) is disadvantageous for potential use as electrolyte material for SOFC applications. The high conductivity and possible depolarization effects suggest potential use as anode materials in SOFC.     

The role of Mg substitution on the microstructure and magnetic properties of Ba Co Zn W-type hexagonal ferrites

A series of W-type hexagonal ferrites with the composition BaCoZn_1−xMg_xFe₁₆O₂₇ (0?x?0.6) were prepared by the conventional ceramic method to study their structural and magnetic properties as a function of temperature and composition. The characterization using X-ray diffraction indicated that a hexagonal W-type single-phase structure and the effect of composition on the unit cell parameters, density and porosity was studied. The variation of the magnetic susceptibility (χ_M) with temperature for all the investigated samples in the temperature range (300–800 K) shows three regions of behavior that was explained on the basis of the distribution of Zn²⁺ and Mg²⁺ ions in the lattice and leads to the anomalous behavior of the effective magnetic moment μ_eff. The Curie temperature indicated that the critical concentration is at x=0.5. Paramagnetic nature of the samples above the Curie temperature is observed. The Curie Weiss constant θ calculated from the plot of 1/χ_M vs. T (K) is in agreement with the expected value. The effective magnetic moment μ_eff decreases with increasing the intensity of magnetic field. The possible mechanisms contributing to these properties are discussed in the text.     

Multiclass analysis on repaglinide,flubendazole, robenidine hydrochloride and danofloxacin drugs

The drugs under study; repaglinide (Repag), flubendazole (Flu), robenidine hydrochloride (Roben) and danofloxacin (Dano) are antidiabetic, anthelmintic, anticoccidial, and antibiotic drugs. In the present study, they are investigated using electron impact mass spectral (EI-MS) fragmentation at 70 eV, in comparison with thermal analyses measurements (TGA/DrTGA and DTA) and molecular orbital calculation (MO). Semi-empirical MO calculation, AM1 procedure, has been carried out on Repag, Flu, Roben and Dano both as neutral molecules (in TA) and the corresponding positively charged species (in MS). The calculated MO parameters include bond length, bond order, charge distribution on different atoms and heat of formation. The fragmentation pathways of Repag, Flu, Roben and Dano in EI-MS led to the formation of important primary and secondary fragment ions. The mechanism of formation of some important daughter ions can be illuminated from comparing with that obtained using mass spectrometer through the accurate mass measurement determination. The MO provides a base for fine distinction among sites of initial bond cleavage and subsequent fragmentation of drug molecules in both thermal analysis and MS techniques. The activation thermodynamic parameters, such as, (activation energy E¹), (enthalpy ΔH¹), (entropy ΔS¹) and (Gibbs free energy ΔG¹) are calculated from the DrTGA curves using Coats–Redfern and Horowitz–Mitzger methods.     

Comparative analysis of the oil and supercritical CO(2) extract of Schinus molle L. growing in Yemen

In this study, we report the preliminary data on the chemical composition of Yemeni Schinus molle L. volatile oil obtained by supercritical extraction with carbon dioxide (40°C and 90?bar), SFE, and by hydrodistillation (HD). The composition of the volatile oil has been analysed by GC and GC-MS. The content of the major constituents in the oils from leaves varied in the following ranges: germacrene D 3.7% in SFE and 16.7% in HD; β-caryophyllene 19.1% in SFE and 13.5% in HD. The amount of monoterpenes constituted 4%, in all the analysed samples, while the number of sesquiterpenes was 44% in supercritical and 67% in HD oil. Some compounds were not identified by GC-MS and it will require further analysis using other analytical techniques.     

Polymer complexes,part XXI. Stereochemical changes of metal chelates of poly(5-vinylsalicylidene-2-benzothiazoline)

Summary Poly(5-vinylsalicylidene-2-benzothiazoline) homopolymer (PVSBH₂) and polymer complexes of 5-vinylsalicylidene-2-benzothiazoline with a number of divalent transition metals have been prepared and characterized using spectral (¹H NMR and¹³C-NMR, IR, UV-VIS) and magnetic measurements. The data suggest that the Co(II), Ni(II), Fe(II) and Mn(II) polymer complexes are octahedral dimers, while the rest are monomeric with square planar tetrahedral geometries.

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Polymere Komplexe, 21. Mitt.: Stereochemische Änderungen in Metallchelaten von Poly(5-vinylsalicyliden-2-benzothiazolinen)

Zusammenfassung Es wurden homopolymere Poly(5-vinylsalicyliden-2-benzothiazolin)-(PVSBH₂) und polymere 5-Vinylsalicyliden-2-benzothiazolin-Komplexe mit einer Reihe von zweiwertigen Metallen hergestellt und mittels spektroskopischer (¹H- und¹³C-NMR, IR, UV-VIS) und magnetischer Messungen charakterisiert. Die Daten erlauben den Schluß, daß es sich bei den Co(II)-, Ni(II)-, Fe(II)- und Mn(II)-Polymerkomplexen um oktahedrale Dimere handelt, während der Rest monomere Strukturen mit planar-tetrahedraler Geometrie zeigt.

     

Synthesis and thermal study of the prodrug of oxamniquine

Oxamniquine polymeric prodrug with potential antischistosomal activity was prepared using dextran T-70 as a carrier, which was analysed by ¹HNMR, ¹³C NMR and IR spectroscopy. The formation of the oxamniquine salt was confirmed by thermogravimetric analysis (TG) and differential scanning calorimetry (DSC) which showed a different thermal behaviour when compared to the physical mixture.     

Electrical conductivity,spectral and magnetic properties of some transition metal complexes derived from dimedone bis(4-phenylthiosemicarbazone)

Summary Co^II, Ni^II, Cu^II, Zn^II, Cd^II and U^VIO₂ complexes of 5, 5-dimethyl-1, 3-cyclohexanone bis(4-phenylthiosemicarbazone), H₂CPT, have been characterized by elemental analysis, i.r. and reflectance spectral studies, and magnetic moment measurements. I.r. spectra show that H₂CPT gives rise to dibasic quadridentate SNNS donor. A square-planar structure is proposed for the copper(II) complex and octahedral for cobalt(II) and nickel(II) complexes according to the magnetic and electronic spectral data. The electrical conductivities of H₂CPT and its CO^II, Ni^II, Cu^II and Cd^II complexes were measured. The positive temperature coefficient (d/dT) and the higher activation energies of H₂CPT and its Cd^II and Cu^II complexes is evidence of their semiconducting character.