Experimental NMR and MS study of benzoylguanidines. Investigation of E/Z isomerism

Molecules containing the guanidinic nuclei possess several pharmacological applications, and knowing the preferred isomers of a potential drug is important to understand the way it operates pharmacologically. Benzoylguanidines were synthesized in satisfactory to good yields and characterized by NMR, Electrospray Ionization Mass Spectrometry (ESI‐MS) and Fourrier Transform InfraRed Spectroscopy techniques (FTIR). E/Z isomerism of the guanidines was studied and confirmed by NMR analysis in solution (¹H‐¹³C Heteronuclear Single Quantum Coherence (HSQC) and Heteronuclear Multiple‐Bond Correlation (HMBC), ¹H‐¹⁵N HMBC, ¹H‐¹H Correlation Spectroscopy (COSY) and Nuclear Overhauser Effect Spectroscopy (NOESY) experiments) at low temperatures. Compounds with p‐Cl and p‐Br aniline moiety exist mainly as Z isomer with a small proportion of E isomer, whereas compounds with p‐NO2 moiety showed a decrease in proportion of isomer Z. The results are important for the application of these molecules as enzymatic inhibitors. Copyright © 2013 John Wiley & Sons, Ltd.     

Magnetic behavior of a nano-disk constrained in an antiferromagnetic substrate

In this work we report a numerical Monte Carlo study of the behavior of a magnetic nano-disk put over an antiferromagnetic substrate. Three approaches were considered for describe the substrate: (1) A stacked antiferromagnetic configuration, (2) an Ising like arrangement and (3) Heisenberg like spins. For the Heisenberg case we still have considered an easy-plane and an easy-axis symmetry of the substrate. The hysteresis loop for the nano-disk is obtained by considering the three cases. The signature of the vortex in the nano-disk appears as small jumps in the hysteresis curve. Exchange bias effects are observed since the substrate has an easy axis symmetry.     

Extreme events in optics: Challenges of the MANUREVA project

In this contribution we describe and discuss a series of challenges and questions relating to understanding extreme wave phenomena in optics. Many aspects of these questions are being studied in the framework of the MANUREVA project: a multidisciplinary consortium aiming to carry out mathematical, numerical and experimental studies in this field. The central motivation of this work is the 2007 results from optical physics [D. Solli et al., Nature 450, 1054 (2007)] that showed how a fibre-optical system can generate large amplitude extreme wave events with similar statistical properties to the infamous hydrodynamic rogue waves on the surface of the ocean. We review our recent work in this area, and discuss how this observation may open the possibility for an optical system to be used to directly study both the dynamics and statistics of extreme-value processes, a potential advance comparable to the introduction of optical systems to study chaos in the 1970s.