Search results for "absorptio"
showing 10 items of 2815 documents
Methylium Ions with OPV Chains − New NIR Dyes
2001
Carbinols, which contain three OPV chains, were generated in convergent syntheses. The extension of the conjugation leads to a bathochromic effect that shifts the absorption from the UV into the visible region. The carbinol series has a convergence limit of the absorption at λmax = 415 nm. The corresponding carbenium ions exhibit a stronger bathochromic shift with the increasing number of repeating units in each chain. Thus, NIR dyes were obtained which show a convergence limit at λmax = 879 nm. The charge distribution in the ground state of the carbocations is discussed on the basis of 13C NMR spectroscopic data.
Monodisperse Oligo(2,5-dipropoxy-1,4-phenyleneethynylene)s
2002
Oligo(phenyleneethynylene)s 1 are rod-like compounds with undisturbed conjugation. In supplementation of the previously described members of this series 1a−e, with repeating units of up to n = 5, this work contains the preparation of higher oligomers 1f−i (n = 6, 7, 8, 10) through the use of the Sonogashira−Hagihara reaction. Both the absorption and the fluorescence bands showed convergence for increasing values of n, reaching limiting values at the effective conjugation length of nECL = 10. (© Wiley-VCH Verlag GmbH, 69451 Weinheim, Germany, 2002)
Crystal and molecular structure of anhydrous betaine, (CH3)3NCH2CO2
1999
Abstract 1–Carboxy–N,N,N–trimethylmethanamanium inner salt or anhydrous betaine, (CH3)3NCH2CO2, FW=117.15 gmol −1 , crystallizes in the orthorhombic space group Pnma with a=14.544(2) A , b=6.859(3) A , c=6.131(1) A , V=611.7(3) A 3 , Z=4, D x =1.27 Mgm −3 , λ (MoK α )=0.71073 A , μ =0.091 mm −1 . The structure was resolved by direct methods and refined by least-square calculations to R=0.038 for 531 reflections. Observed changes in bond angles imply that there is a repulsion between nitrogen and oxygen. The melting point (measured at onset) is 570 K. FTIR spectra of anhydrous betaine and monohydrate were recorded. Clear differences were found between the two compounds based on infrared (i.r…
Impact of the synergistic collaboration of oligothiophene bridges and ruthenium complexes on the optical properties of dumbbell-shaped compounds.
2012
The linear and non-linear optical properties of a family of dumbbell-shaped dinuclear complexes, in which an oligothiophene chain with various numbers of rings (1, 3, and 6) acts as a bridge between two homoleptic tris(2,2'-bipyridine)ruthenium(II) complexes, have been fully investigated by using a range of spectroscopic techniques (absorption and luminescence, transient absorption, Raman, and non-linear absorption), together with density functional theory calculations. Our results shed light on the impact of the synergistic collaboration between the electronic structures of the two chemical moieties on the optical properties of these materials. Experiments on the linear optical properties …
Anisotropy of the refractive index and absorption coefficient in the layer plane of gallium telluride single crystals
1995
Refractive index and absorption coefficient of GaTe for light polarized in the optical axis directions in the layer plane are determined from transmission measurements. The refractive index is determined in the wavelength range from 0.7 to 25 μm and the absorption coefficient in the range of energies from 1.6 to 2 eV at room temperature and at 30 K. The optical constants are found to be anisotropic in the layer plane. The refractive index dispersion is interpreted through a Phillips-Van Vechten model and the Penn gaps for each direction are found to be E pg (⊥b) = 3.37 eV and E pg (∥b) = 3.58 eV. In the long-wavelength region a polar phonon contribution is also taken into account. The absor…
Localized excitation effect on dipole moments of oligophenylenevinylenes in their excited Franck–Condon state
2010
Abstract The results from electrooptical absorption measurements (EOAM) on the ground and excited Franck–Condon state dipole moments of oligophenylenevinylenes in 1,4-dioxane and cyclohexane are presented. The dipole moments of quadrupolar dyes in the ground state are not equal zero. This means that one of the functional end groups of these molecules is not on the axis or on the plane with the central part of the molecule. Such a conclusion is confirmed by the quantum-chemical and semi-empirical recalculations. Owing to disorder in the ground-state geometry of the dyes the π–π conjugated system is located on mostly the plane part of the molecule and in the main this part absorbs the light. …
Time-resolved luminescence and induced absorption in PbWO4
1997
Abstract Luminescence and short-lived induced absorption are studied for two undoped PbWO4 crystals. Luminescence decay at LNT is delayed relative to irradiation pulse. The delay observed is either due to reabsorption of luminescence or due to creation of luminescence center excited states via energy or/and charge transfer after irradiation pulse. Short-lived absorption is observed within 1.1–3.6 eV spectral region at LNT as well as at RT. It is proposed that the short-lived absorption band peaking at ~ 3.5 eV is intrinsic.
Solvatochromy and symmetry breaking in two quadrupolar oligophenylenevinylenes
2020
Electrooptical absorption measurements (EOAM), solvatochromic dependences and quantum chemical simulations testify to large dipole moments change of two quadrupolar oligophenylenevinylenes upon transition to Franck-Condon excited state μeFC. The values of the dipole moments μg and μeFC are in the range [(4.2 - 4.9)1030] C m and (30.8 - 47.0)1030C m, respectively. The relations of dipole moments in the ground and excited states determined by EOAM correlate well with results obtained via the solvatochromic method. Calculations carried out by density functional theory (DFT) show that optimized configuration of the ground state of these molecules is not planar. The results from all methods appl…
Vibrational analysis of the electronic spectrum of ethylene based onab initio SCF-CI calculations
1972
Ab initio calculations for CH2 twisting and CC stretching vibrational wavefunctions and energy levels are reported for various electronic states of ethylene C2H4. Electronic transition moments between these states are also obtained to allow a calculation of the oscillator strengths for vibrational transitions involved in various electronic band systems; from this study it is concluded that thevertical electronic energy differenceΔE e may differ significantly from the energy of the absorption maximumΔE max with which it is often equated. In particular it is found in the case of theπ→π * singlet-singlet excitation of ethylene that theΔE e value overestimates the most probable vibrational tran…
The importance of incorporating a waste detoxification step in analytical methodologies
2015
The introduction of a waste detoxification step in the analytical process was highlighted using, as example, the determination of copper in pesticide formulations using electrogravimetry, flame atomic absorption spectroscopy and inductively coupled plasma optical emission spectroscopy. This quantitative study showed the improvement of the previously mentioned analytical methods, from a green perspective, after addition of electrodeposition or neutralization steps to the analytical process. Based on this, the application of the eco-scale and the Green Certificate to the evaluation of these methodologies allows the method to be moved from the B and C classes to the A class.