Ru(TPP)CO]-Catalysed Intramolecular Benzylic CH Bond Amination, Affording Phenanthridine and Dihydrophenanthridine Derivatives

Shedding light on azides: [Ru(TPP)CO] (TPP=tetraphenyl porphyrin dianion), white light and O(2) were found to be a suitable catalyst combination to perform the annulation of several biaryl azides. The high chemoselectivity of the process allows the synthesis of phenanthridines and dihydrophenanthridines in good yield and purity.     

Water confined in MCM-41: a mode coupling theory analysis

In this paper we analyze molecular dynamics simulation results on supercooled water in a MCM-41 pore in order to test the mode coupling theory. A layer analysis must be performed for water in the pore in order to exclude the contribution of water bound to the strongly hydrophilic surface. Upon supercooling a range of temperatures is reached where the liquid follows the mode coupling theory. From the power law behavior of the relaxation times extracted from the Kohlrausch-William-Watts fit to the self-intermediate scattering function, we obtain the crossover temperature T(C) and the γ exponent of the theory. The time-temperature superposition principle is also satisfied. A fit to the von Schweidler law yields a coefficient b from which all the other parameters of the theory have been calculated. In particular, we obtained the same value of γ as extracted from the power law fit to the relaxation times, in agreement with the requirements of the theory. For very low temperatures, the mode coupling theory no longer holds as hopping processes intervene and water turns its behavior to that of a strong liquid.     

Inclusion Complex between Local Anesthetic/2-hydroxypropyl-β-cyclodextrin in Stealth Liposome

The drugs delivery system in the treatment of diseases has advantages such as reduced toxicity, increased availability of the drug, etc. Therefore, studies of the supramolecular interactions between local anesthetics (LAs) butamben (BTB) or ropivacaine (RVC) complexed with 2-hydroxypropyl-β-cyclodextrin (HP-βCD) and carried in Stealth liposomal (SL) are performed. ¹H-NMR nuclear magnetic resonance (DOSY and STD) were used as the main tools. The displacements observed in the ¹H-NMR presented the complexion between LAs and HP-βCD. The diffusion coefficients of free BTB and RVC were 7.70 × 10⁻¹⁰ m² s⁻¹ and 4.07 × 10⁻¹⁰ m² s⁻¹, and in the complex with HP-βCD were 1.90 × 10⁻¹⁰ m² s⁻¹ and 3.64 × 10⁻¹⁰ m² s⁻¹, respectively, which indicate a strong interaction between the BTB molecule and HP-βCD (98.3% molar fraction and Ka = 72.279 L/mol). With STD-NMR, the encapsulation of the BTB/HP-βCD and RVC/HP-βCD in SL vesicles was proven. Beyond the saturation transfer to the LAs, there is the magnetization transfer to the hydrogens of HP-βCD. BTB and RVC have already been studied in normal liposome systems; however, little is known of their behavior in SL.     

A new algorithm for the propositional satisfiability problem

A new enumeration algorithm is proposed for the propositional satisfiability problem. Such algorithm is based on a hypergraph formulation of the problem. Two different implementations of the algorithm are presented together with the results of an experimentation intended to compare their performance with the performance of other known methods. The computational results obtained are quite promising.     

An O(n log n) algorithm for the convex bipartite matching problem

An efficient algorithm to solve the maximum cardinality matching problem in convex bipartite graphs is presented. In the algorithm use is made of a special data structure based on a binary heap.     

Determination of the acyl moieties of the antibiotic complex A40926 and their relation with the membrane lipids of the producer strain.

Structures of the fatty acid residues characterizing the various components of A40926 were determined by gas chromatography/mass spectrometry on the methyl esters obtained by methanolysis of the complex. The results confirm the residues previously assigned to Factor A (n-undecanoic acid) and B (10-methyl-undecanoic acid) and establish the residues of Factor A1 (9-methyl-decanoic acid), B1 (n-dodecanoic acid), RS1 (8-methyl-nonanoic acid), RS2 (n-decanoic acid), and RS3 (n-tridecanoic acid). As the Actinomadura species contain in their mycelia large quantities of C15-C17 fatty acid residues as membrane phospholipids, these mycelia were saponified and the fatty acids obtained were analyzed as above. There is a close correlation between the fatty acid content of A40926 complex and that of the longer homologues in the producer mycelia.     

Decay of fluorescence emission of KI: Cu+

Summary Lifetime and quantum yield measurements concerning the fluorescence of Cu⁺ impurity centre in KI were performed in the range 19–300 K. The emission mechanism was shown to involve two excited states in thermal equilibrium, one of them being metastable and lying close under the emitting level,i.e. according to the Pedrini model for Cu⁺ fluorescence in alkali halides.