Search results for "Polar"
showing 10 items of 3817 documents
Voltammetric behaviour of monomeric fac-trioxomolybdenum(VI) complexes with aminocarboxylic ligands in aqueous media
1992
Abstract Cyclic voltammetry, polarography and controlled-potential coulometry experiments have been used to characterize the electrochemical reduction of fac-MoO3L2− complexes (L = aspartic acid or iminodiacetic acid) in aqueous media. These complexes are reduced in two irreversible proton-assisted steps to give an oxo-bridged molybdenum(V) species and then to a molybdenum(III) dimer species. At pH 4.5, the former reduction step for the iminodiacetic acid ligand occurs at Ep = −0.75 V, while the second one appears at −1.12 V vs SCE. The overall electrochemical process can be described in terms of a homogeneous chemical reaction, coupled between two electron transfers (ECE mechanism), that i…
Supramolecular Nanocycles Comprisingβ-Cyclodextrin-click-Ferrocene Units: Rings of Rings of Rings
2010
We applied 1,3-dipolar cycloaddition to bind ethynylferrocene onto 6I-azido-6I-deoxycyclomaltoheptaose under microwave assisted conditions. The process was investigated by (1) H NMR, FT-IR spectroscopy, and MALDI-TOF mass spectrometry. The ability of the synthesized compound to self-organize to cyclic supramolecular structures was investigated by dynamic light scattering measurements and cryo-transmission electron microscopy.
Electron crystallography and organic materials with non-linear optical properties
1999
Results of electron microscopic studies of crystal structures of a number of bis-benzylidene cyclohexanones are presented. It is shown that some of these compounds are efficient crystalline non-linear optically active (NLO) chromophores with second harmonic generation (SHG) properties. Appropriately functionalized chromophores of this type can be used as a polycondensation comonomer to produce partly crystalline main-chain NLO-active polymers. Electron diffraction crystal structural data, obtained for very small crystals, allowed us to get reasonable estimations of macroscopic crystal NLO-coefficients, relating quantum-chemically calculated molecular first hyperpolarizability components to …
Single molecule probing of dynamics in supercooled polymers
2011
6 pages; International audience; Fluorescence experiments with single BODIPY molecules embedded in a poly(methyl acrylate) matrix have been performed at various temperatures in the supercooled regime. By using pulsed excitation, fluorescence lifetime and linear dichroism time trajectories were accessible at the same time. Both observables have been analyzed without data binning. While the linear dichroism solely reflects single particle dynamics, the fluorescence lifetime observable depends on the molecular environment, so that the dynamics from the polymer host surrounding a chromophore contributes to this quantity. We observe that the lifetime correlation decays slightly faster than polar…
Insight in NLO Polymer Material Behavior from Langevin Dynamic Modeling of Chromophore Poling
2011
Calculation of chromophore polar order, i.e. the polarization of nonlinear optically (NLO) active polymers poled by external field, is challenging. One possible solution is to reproduce the orientation polarization of chromophores under external field using Langevin dynamics (LD) molecular modeling. The present work investigates the influence of chromophore dipole moment, density and field extent on NLO efficiency and polarization/relaxation dynamics. Results of simulations convince us, that the method is applicable for modeling real NLO polymers. In the spotlight of this investigation we would like to describe a NLO polymer as a “ferrofluid” where chromophores are active particles or elect…
On the Correlations Between Constitution and Scintillation Properties in the p-Oligophenylene Series
1968
Abstract The paper deals with the problem: What properties are requested from an organic scintillator solute and what structural principles are given to realize, or at least to influence them especially by looking at the p-oligophenylene series? According to their importance and also in respect to more or less special purposes one can distinguish the following sequence: 1) An organic scintillator solute must have a sufficient solubility in all types of solvents used for this counting method. As a result of extensive systematic studies substitution of larger alkyl groups has been recognized as a very effective principle of solubilization. By use of branched, particularly long-chain branched …
Synthesis, crystal structures, and solid state quadratic nonlinear optical properties of a series of stilbazolium cations combined with gold cyanide …
2011
Three salts built up from (E)-4′-(dimethylamino)-stilbazolium (DMAS)H+, (E)-4′-(diethylamino)-stilbazolium (DEAS)H+, (E)-4′-{2-(methoxymethyl) pyrrolidinyl}-stilbazolium (MPS)H+, and gold cyanide as a counter-ion, are reported. The crystal structures have been solved for (DEAS)H+ Au(CN)2− (Cc space group), and for (MPS)H+ Au(CN)2− (P1 space group). The semi-empirical (ZINDO) calculated static hyperpolarizability (β0) of (MPS)H+ is equal to 147 × 10−30 cm5esu−1, in solid state, which is 25% higher than that of the cation of the well known (E)-4′-(dimethylamino)-methylstilbazolium tosylate (DAST). (MPS)H+ Au(CN)2− exhibits a unique crystal structure in which the cations are perfectly aligned.…
Dinuclear copper(II) complexes as testing ground for molecular magnetism theory
2019
Abstract A leitmotiv in the field of molecular magnetism is the study of the electron exchange (EE) magnetic interactions among distant metal centers through the corresponding bridging ligands in polynuclear coordination compounds. The present review provides a historical perspective on the use of dinuclear copper(II) complexes with either simple inorganic or extended organic bridging ligands as experimental and theoretical models for the fundamental research on the relative importance of the spin delocalization and spin polarization mechanisms of the EE interaction across σ- and π-type orbital pathways. Particular focus is placed on the work by Professor Miguel Julve, outstanding researche…
Topology and Spin Polarization in Sheetlike Metal(II) Polymers: [ML2X2] (M ˭ Mn, Fe, Co or Ni, L = Pyrimidine or Pyrazine and X = NCS or NCO)
1999
The preparation and the structural and magnetic characterization of a series of sheetlike transition metal polymers of formula [ML2X2] [M ˭ Mn(II), Fe(II), Co(II) and Ni(II): L = pyrazine (pyz) and...
Triarylamines connected via phenylenevinylene segments
2003
Abstract The influences of the conjugation length and of side chains with various electronic character on the electro-optical properties of oligo(phenylenevinylene)s end-capped with diphenylamino groups are investigated. Horner-Olefinations were used for the synthesis of chromophores with 3–7 rings in the conjugated system, additionally, Pd-catalysed amination of bromo-OPVs is a useful route to introduce the end groups. Compared with the “electronically neutral” alkyl side chains, electron donating ethers and, more pronounced, electron withdrawing sulfonyl side chains shift the absorption and emission spectra to longer wavelengths. The elongation of the π-system from 3 to 5 and 7 rings has …