Nitração aromática: substituição eletrofílica ou reação com transferência de elétrons?

Aromatic nitration is one of the most relevant class of reactions in organic chemistry. It has been intensively studied by both experimental, including works in the condensed as well as in the gas phase, and theoretical procedures. However, the published results do not seem to converge to an unique mechanism. Electrophilic substitution and electron transfer, in an exclusive way, are both proposed as the main mechanism for the reaction. We review these proposals and discuss the most recent findings.

Transferência de elétrons em sistemas inorgânicos de valência mista

This article reports on some basic and conceptual principles concerning electron transfer (ET) and/or intervalence transfer (IT) phenomena in inorganic mixed-valence systems.

Transferência de energia entre corantes catiônicos em sistemas homogêneos

In this work, the energy transfer by dipole-dipole interaction between cationic dyes in n-alcohols (methanol, ethanol, 1-propanol and 1-butanol) is studied by time resolved and steady state fluorescence measurements. The critical radii of energy transfer were determined by three independent methods; the spectral overlap, fluorescence decay profiles, and relative intensity measurements. In all solvents, R0 values of the dye pairs obtained from spectral overlap were between 40 to 90 Å. Steady state and time resolved fluorescence measurements resulted in values of R0 in the range of 50 - 80 Å, with good correlation of values.

Transferència tecnològica

Es pot fer una anàlisi sobre les diferències entre les universitats que transfereixen molt coneixement i les nostres. També, es poden comparar les condicions socioeconòmiques, en relació a la creació d'empreses, i els 'clients' de les universitats, en relació als contractes de transferència. Aquesta informació ens pot ajudar a decidir què podem fer per millorar aquests pobres resultats

Les Unitats de transferència i comercialització de tecnologia universitària

Aquest article presenta els resultats de l’anàlisi de cinquanta-dues unitats de transferència de tecnologia generada al sector públic. L’objectiu de l’anàlisi era aportar informació i coneixement adreçats a facilitar en el nostre entorn el disseny d’unitats de comercialització de patents i spin-offs per part de les autoritats universitàries i de les agències d’innovació. El projecte ha estat finançat pel Centre d'Innovació i Desenvolupament Empresarial (CIDEM) de la Generalitat de Catalunya

Relação entre transferência de carga e as interações intermoleculares em complexos de hidrogênio heterocíclicos

Hydrogen-bonded complexes formed by the interaction of the heterocyclic molecules C2H4O and C2H5N with HF, HCN, HNC and C2H2 have been studied using density functional theory. The hydrogen bond strength has been analyzed through electron density charge transfer from the proton acceptor to the proton donor. The density charge transfer has been estimated using different methods such as Mulliken population analysis, CHELPG, GAPT and AIM. It has been shown that AIM-estimated charge transfer correlates very well with the hydrogen bond energy and the infrared bathochromic effect of the proton donor stretching frequencies.

Moda embrionària

El cos dels humans actuals és força fràgil, molt més que el dels Neardentals, per exemple, per la qual cosa en molts indrets de la Terra ens cal protegir-lo amb diversos tipus de vestits, segons el clima. Els primers vestits els vam manllevar dels animals, dels quals aprofitàvem les pells. Ara, una dissenyadora ha manllevat el procés de formació d'un ésser humà i l'ha transformat en moda [...].

Transferência de calibração em métodos multivariados

Calibration transfer has received considerable attention in the recent literature. Several standardization methods have been proposed for transferring calibration models between equipments. The goal of this paper is to present a general revision of calibration transfer techniques. Basic concepts will be reviewed, as well as the main advantages and drawbacks of each technique. A case study based on a set of 80 NIR spectra of maize samples recorded on two different instruments is used to illustrate the main calibration transfer techniques (direct standardization, piecewise direct standardization, orthogonal signal correction and robust variable selection).

Desenvolupament d'un sistema de transferència de software per una placa entrenadora

El departament d’electrònica i telecomunicacions de la Universitat de Vic ha dissenyat un conjunt de plaques entrenadores amb finalitat educativa. Perquè els alumnes puguin utilitzar aquestes plaques com a eina d’estudi, és necessari disposar d’un sistema de gravació econòmic i còmode. La major part dels programadors, en aquest cas, no compleixen amb aquests requeriments. L’objectiu d’aquest projecte és dissenyar un sistema de programació que utilitzi la comunicació sèrie i que no requereixi d'un hardware ni software específics. D’aquesta manera, obtenim una placa autònoma i un programador gratuït, de muntatge ràpid i simple d’utilitzar. El sistema de gravació dissenyat s’ha dividit en tres blocs. Per una banda, un programa que anomenem “programador” encarregat de transferir codi de programa des de l’ordinador al microcontrolador de la placa entrenadora. Per altra banda, un programa anomenat “bootloader”, situat al microcontrolador, permet rebre aquest codi de programa i emmagatzemar-lo a les direccions de memòria de programa corresponents. Com a tercer bloc, s’implementa un protocol de comunicació i un sistema de control d’errors per tal d’assegurar una correcta comunicació entre el “programador” i el “bootloader”. Els objectius d’aquest projecte s’han complert i per les proves realitzades, el sistema de programació ha funcionat correctament.

Transferência trófica de mercúrio e selênio na costa norte do Rio de Janeiro

Trophic transfer of trace elements along marine food chains has been recognized as an important process influencing metal and metalloid bioaccumulation. The trophic transfer of mercury was observed between trophic levels from prey (considering fish with different feeding habits and squid) to top predator (dolphin) in a Northern coastal food chain of Rio de Janeiro. Selenium showed some evidence of trophic transfer between lower trophic levels. Dolphin presented the highest mercury concentrations whereas the benthic carnivorous fish showed the highest selenium concentrations. Mercury is biomagnified through the food chain while selenium does not present the same behavior.

Determinação espectrofotométrica de cefalexina em formulações farmacêuticas explorando a sua reação de transferência de carga com a quinalizarina

This work proposes a new simple and fast spectrophotometric method for cephalexin determination in pharmaceutical formulations. The method is based on the charge transfer reaction between cephalexin and quinalizarin in dimethylsulfoxide medium. Several analytical parameters related to the system were optimized and the reaction was characterized in terms of stoichiometry. Also, association constant and apparent molar absorptivity of the product were determined. The method presented a limit of detection of 0.46 mg L-1 and a quantification limit of 1.5 mg L-1. It was successfully applied in the determination of cephalexin in two samples of commercial pharmaceutical formulations.

Transferência de elétron inversa na quimiexcitação da reação peróxi-oxalato usando ativadores facilmente redutíveis

Chemiluminescence properties of the peroxyoxalate reaction in the presence of activators bearing electron withdrawing substituents were studied, to evaluate the possible occurrence of an inverse electron transfer, from the peroxide intermediate to the activator, in its chemiexcitation step. Relative catalytic rate constants and singlet quantum yields were obtained for the peroxyoxalate reaction, using 9-chloro, 9,10-dichloro, 9-cyano and 9,10-dicyanoanthracenes as activators. The linear free-energy correlation of the relative rate constants with the activators' reduction potentials and the dependence of the quantum yields on the released energy confirm, for the first time, the occurrence of this inverse electron transfer.

Simulação Monte Carlo de mecanismo de transferência de energia de excitação eletrônica: modelo de Perrin para a supressão estática da luminescência

A software based in the Monte Carlo method has been developed aiming the teaching of the Perrin´s model for static luminescence quenching. This software allows the student to easily simulate the luminescence decays of emissive molecules in the presence of quenching ones. The software named PERRIN was written for FreeBASIC compiler and it can be applied for systems where the molecules remain static during its excited state lifetime. The good agreement found between the simulations and the expected theoretical results shows that it can be used for the luminescence and excited states decay kinetic teaching.