The nature of the Cr-C bond: direct estimation of aromaticity in Fischer carbenes

Report for the scientific sojourn at the the Philipps-Universität Marburg, Germany, from september to december 2007. For the first, we employed the Energy-Decomposition Analysis (EDA) to investigate aromaticity on Fischer carbenes as it is related through all the reaction mechanisms studied in my PhD thesis. This powerful tool, compared with other well-known aromaticity indices in the literature like NICS, is useful not only for quantitative results but also to measure the degree of conjugation or hyperconjugation in molecules. Our results showed for the annelated benzenoid systems studied here, that electron density is more concentrated on the outer rings than in the central one. The strain-induced bond localization plays a major role as a driven force to keep the more substituted ring as the less aromatic. The discussion presented in this work was contrasted at different levels of theory to calibrate the method and ensure the consistency of our results. We think these conclusions can also be extended to arene chemistry for explaining aromaticity and regioselectivity reactions found in those systems.In the second work, we have employed the Turbomole program package and density-functionals of the best performance in the state of art, to explore reaction mechanisms in the noble gas chemistry. Particularly, we were interested in compounds of the form H--Ng--Ng--F (where Ng (Noble Gas) = Ar, Kr and Xe) and we investigated the relative stability of these species. Our quantum chemical calculations predict that the dixenon compound HXeXeF has an activation barrier for decomposition of 11 kcal/mol which should be large enough to identify the molecule in a low-temperature matrix. The other noble gases present lower activation barriers and therefore are more labile and difficult to be observable systems experimentally.

An image quality comparison of standard and dual-side read CR systems for pediatric radiology.

An objective analysis of image quality parameters was performed for a computed radiography (CR) system using both standard single-side and prototype dual-side read plates. The pre-sampled modulation transfer function (MTF), noise power spectrum (NPS), and detective quantum efficiency (DQE) for the systems were determined at three different beam qualities representative of pediatric chest radiography, at an entrance detector air kerma of 5 microGy. The NPS and DQE measurements were realized under clinically relevant x-ray spectra for pediatric radiology, including x-ray scatter radiations. Compared to the standard single-side read system, the MTF for the dual-side read system is reduced, but this is offset by a significant decrease in image noise, resulting in a marked increase in DQE (+40%) in the low spatial frequency range. Thus, for the same image quality, the new technology permits the CR system to be used at a reduced dose level.

Evaluation of RbCl and CrCl3 as markers of Triatoma brasiliensis (Hemiptera: Reduviidae) nymphs: persistence and influence of Rb and Cr on triatomine biology

In order to mark Triatoma brasiliensis, the vector of Chagas disease in Brazil, two chemical compounds, rubidium chloride (RbCl) and chromium chloride (CrCl3), were tested. First, 199 N2-N5 nymphs were fed on blood with 0.025M RbCl. Rb marker positivity ranged from 2.5% (N3)-70% (N2), with a maximum persistence of 98 days. Second, 265 N2-N5 nymphs were fed on blood containing 0.0015M CrCl3. Cr marker positivity ranged up to 93% (N5), with a maximum persistence of 119 days. Finally, we blood fed 213 T. brasiliensis to investigate whether CrCl3 altered the biology of this insect. The developmental time of T. brasiliensis was unaltered, but the survival of the Cr-marked group was lower than that of the control group. Differences in the mean fecundity of the control (mean of 156.1) and experimental (mean of 135.6) groups were not statistically significant and 100% of the egg batches of females Cr-marked as nymphs were positive. In conclusion, CrCl3 is a useful tool for marking T. brasiliensis nymphs due to its high positivity and persistence.

The first report of the qnrB19, qnrS1 and aac(6´)-Ib-cr genes in urinary isolates of ciprofloxacin-resistant Escherichia coli in Brazil

In this study, we investigated the presence of plasmid-mediated quinolone resistance (PMQR) genes among 101 ciprofloxacin-resistant urinary Escherichia coli isolates and searched for mutations in the quinolone-resistance-determining regions (QRDRs) of the DNA gyrase and topoisomerase IV genes in PMQR-carrying isolates. Eight isolates harboured the qnr and aac(6')-Ib-cr genes (3 qnrS1, 1 qnrB19 and 4 aac(6')-Ib-cr). A mutational analysis of the QRDRs in qnr and aac(6')-Ib-cr-positive isolates revealed mutations in gyrA, parC and parE that might be associated with high levels of resistance to quinolones. No mutation was detected in gyrB. Rare gyrA, parC and parE mutations were detected outside of the QRDRs. This is the first report of qnrB19, qnrS1 and aac(6')-Ib-cr -carrying E. coli isolates in Brazil.

Evaluation of three automated systems for susceptibility testing of enterobacteria containing qnrB, qnrS, and/or aac(6')-Ib-cr.

The accuracy of the MicroScan WalkAway, BD Phoenix, and Vitek-2 systems for susceptibility testing of quinolones and aminoglycosides against 68 enterobacteria containing qnrB, qnrS, and/or aac(6 ')-Ib-cr was evaluated using reference microdilution. Overall, one very major error (0.09%), 6 major errors (0.52%), and 45 minor errors (3.89%) were noted.

Kuranishi type Moduli Spaces for proper CR submersions fibering over the circle

Kuranishi's fundamental result (1962) associates to any compact complex manifold X&sub&0&/sub& a finite-dimensional analytic space which has to be thought of as a local moduli space of complex structures close to X&sub&0&/sub&. In this paper, we give an analogous statement for Levi-flat CR manifolds fibering properly over the circle by describing explicitely an infinite-dimensional Kuranishi type local moduli space of Levi-flat CR structures. We interpret this result in terms of Kodaira-Spencer deformation theory making clear the likenesses as well as the differences with the classical case. The article ends with applications and examples.

Variétés CR polarisées et G-polarisées, partie I

Polarized and G-polarized CR manifolds are smooth manifolds endowed with a double structure: a real foliation &em&F&/em& (given by the action of a Lie group G in the G-polarized case) and a transverse CR distribution. Polarized means that (E,J) is roughly speaking invariant by&em&F&/em&. Both structures are therefore linked up. The interplay between them gives to polarized CR-manifolds a very rich geometry. In this paper, we study the properties of polarized and G-polarized manifolds, putting special emphasis on their deformations.

[Félix] Léonard [portrait du boxeur français, salle Cré] : [photographie de presse] / [Agence Rol]

Référence bibliographique : Rol, 57120

M. Cré [dans la salle de boxe portant son nom, 56 rue Rodier, à Paris] : [photographie de presse] / [Agence Rol]

Référence bibliographique : Rol, 57118

Walter Ross [boxeur anglais, s'entraînant salle Cré, rue Rodier, à Paris] : [photographie de presse] / [Agence Rol]

Référence bibliographique : Rol, 57121

Dumas [portrait du boxeur, salle Cré] : [photographie de presse] / [Agence Rol]

Référence bibliographique : Rol, 57119

Comentario general del crucero de evaluación del recurso merluza ejecutado en otoño de 1995 (Cr. BIC SNP-1, 9505-06)

Presenta las observaciones realizadas desde hace varios años, investigadas por el Instituto del Mar del Perú a través de su programa de seguimiento de pesqueras demersales y costeras, y de la evaluación directa de los stocks de peces de mar.

Aspectos metodológicos de la evaluación directa de la merluza (meluccius gayi peruanus) con el método del área barrida (Cr.BIC SNP-1, 9505-06)

Revisión de los principales problemas que se han presentado en la aplicación del método de área barrida para evaluar el stock de merluza en el Perú. Se indica que, entre otros, el desconocimiento de los factores que regulan el comportamiento migratorio de la merluza (tanto nictemeral como estacional) es una permanente fuente de sesgo en los estimados de biomasa. Asimismo, se describen algunos de los pasos que se dieron durante la ejecución del crucero de evaluación de merluza en 1995 que intentan mejorar la aplicación de esta metodología.

Comportamiento de la red de arrastre de fondo (Cr. BIC SNP-1, 9505-06)

Presenta las principales características del comportamiento de la red de arrastre de fondo tipo Granton 400/127 utilizada durante el crucero de evaluación del recurso merluza efectuada en otoño de 1995. Se analiza la captura por subáreas y por estrato de profundidad, observadas en 100 lances de comprobación. Se dan resultados de la geometría de la red de arrastre en sus diferentes niveles. Se obtiene la relación de la profundidad con la longitud del cable para cada estrato de profundidad; así mismo, de la ruptura por unidad de esfuerzo por subárea.

Situación de la población de merluza (Merluccius gayi peruanus) en otoño de 1995 (Cr. BIC SNP-1 9505-06, Evaluación de recurso merluza)

Se efectuó un crucero de evaluación del recurso merluza aplicando la metodología de Área Barrida, para determinar el nivel poblacional y la estructura por tamaños del stock disponible sobre la plataforma. Se estimó una biomasa de 244 mil toneladas con límites de confianza del 28 % para un nivel de significación del 90 %. El stock presentó una estructura por edades con una fuerte presencia de ejemplares de 1, 2 y 3 años de edad que en conjunto representaron más del 80 % de la biomasa. Las mayores concentraciones se presentaron en la subárea O (06"S). Se estima que este nivel poblacional es uno de los más bajos en los últimos años, pero dadas las características de la estructura por edades, se espera un reforzamiento del stock explotable en el corto plazo.