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61.
This paper considers the prospect for there being multiple solutions to the control of classically modelled molecular dynamical systems. The research presented here follows up on a parallel study based on quantum mechanics. For polyatomic molecules it is generally expected that a classical mechanical model will be adequate and necessary as a means for designing optical fields for molecular control. The prospect for multiple control field solutions existing in this domain is important to establish in terms of ultimate laboratory realization of molecular control. A general formulation of the multiplicity problem is considered and the existence of a denumerably infinite number of solutions for the control field amplitude is shown to be the case under certain mild limitations on the physical variables. 相似文献
62.
Dušan J. Radanović Zoran D. Matović Gustavo Ponticelli Paola Scano Inessa A. Efimenko 《Transition Metal Chemistry》1994,19(6):646-650
Summary The synthesis and characterization of AuIII complexes with several heterocyclic ligands are reported. The compounds have general formula [AuX3(L)], where L =N-methylimidazole (N-MeIz),N-ethylimidazole (N-EtIz),N-propylimidazole (N-PrIz), benzoxazole (BO), 2-methylbenzoxazole (2-MeBO), 2,5-dimethylbenzoxazole (2,5-diMeBO), 2-amino-pyrimidine (2-APm), 4(6) -hydroxy-pyrimidine [4(6)-hydrPm] or hypoxanthine (Hypox) and X = Cl or Br. Elemental analysis, conductivity measurements and spectral studies were used for the characterization of the complexes. A square-planar geometry withN-bonded heterocyclic ligands is suggested. 相似文献
63.
A new liquid chromatographic (LC)-chemometric approach was developed for the determination of sunset yellow (SUN) and tartrazine (TAR) in commercial preparations. This approach uses LC and chemometric calibration methods, i.e., classical least-squares (CLS), principal component regression (PCR), and partial-least squares (PLS), simultaneously. The combined LC-chemometric approaches, denoted as LC-CLS, LC-PCR, and LC-PLS, are based on photodiode array (PDA) detection at multiple wavelengths. Optimum chromatographic separation of SUN and TAR with allura red as the internal standard (IS) was obtained by using a Waters Symmetry C18 column, 5 microm, 4.6 x 250 mm, and 0.2 M acetate buffer (pH 5)-acetonitrile-methano-bidistilled water (55 + 20 + 15 + 10, v/v) as the mobile phase at a flow rate of 1.9 mL/min. The LC data sets consisting of the ratios of analyte peak areas to the IS peak area were obtained by using PDA detection at 5 wavelengths (465, 470, 475, 480, and 485 nm). LC-chemometric calibrations for SUN and TAR were separately constructed by using the relationship between the peak-area ratio and the training sets for each colorant. LC-chemometric approaches were tested for different synthetic mixtures containing SUN and TAR in the presence of the IS. These LC-chemometric calibrations were applied to a commercial preparation of the 2 colorants. The experimental results of the LC-chemometric approaches were compared with those obtained by a developed classical LC method using single-wavelength detection. 相似文献
64.
Štefan Marchalín Dušan Ilavský Milan Bruncko 《Monatshefte für Chemie / Chemical Monthly》1989,120(12):1101-1105
Summary Good yields of substituted 5-(5R-2-furyl)-4H-pyrano[2,3-d]pyrimidines4 were obtained in the reaction of 2-ethoxymethyleneamino-3-cyano-4H-pyranes2 with ammonia. Compounds2 were prepared by the condensation of the starting 2-amino-5-acetyl-3-cyano-6-methyl-4H-pyranes1 with ethyl orthoformate. Spectral properties of the bicyclic system4 in relation to compounds3 are discussed. 相似文献
65.
Feng Zhao Yu-Kou Du Ping Yang Ji’an Tang Xing-Chang Li 《Colloid and polymer science》2005,283(12):1361-1365
In the present study, the structure and morphology of single sodium poly(styrenesulfonate) (PSS) molecules adsorbed to mica
surface from the natural aqueous solution is investigated using atomic force microscopy technique. Results show that single
PSS molecules are observed which show a morphology of wormlike coils. Meanwhile, single sodium poly(styrenesulfonate) (PSS)/Hexadecyltrimethylammonium
bromide (CTAB) complexes deposited on mica from the air–water interface are also observed. However, the PSS/CTA+ complexes show different conformations by appearing in the morphology of circular patches. Experimental data are in fair
agreement with the theoretical analysis. 相似文献
66.
The object of this paper has been to determine the effect of water of crystallization on magnetic properties of MgSO4. Changes in the magnetic properties of MgSO4 in depenedence on the number of waters of crystallization have been established from the magnetic susceptibility changes. The value obtained by measurement differs from that calculated by the additivity law. This disagreement can be explained by the presence of the thermally independent Van Vleck's polarization paramagnetism
p
.The paper brings forward calculations of p values for the individual hydrates of MgSO4.i H2O fori=0, 1, ..., 7. Besides, it examines what portion of the polarization paramagnetism
pi
of the overall values of
pci is due to the effect of water of crystallization. On the basis of this information the deviation from the spherical symmetry, caused by hydration of the MgSO4 molecule, has been interpreted. 相似文献
67.
A bifunctional amido-thiophene namely hexamethylene (bis-3-thiophene acetamide) (HMTA) was synthesized by the reaction of 3-thiophene acetic acid with hexamethylene diamine. Copolymerization in the presence of thiophene was achieved electrochemically in tetrabutylammonium tetrafluoroborate/acetonitrile (TBAFB/AN). Spectroelectrochemical analysis of the resulting copolymer [P(HMTA-co-Th)] reflected electronic transitions at 505 nm, 740 nm and ∼1000 nm, revealing π to π* transition, polaron and bipolaron band formation respectively. Switching ability was evaluated by a kinetic study via measuring the transmittance (%T) at the maximum contrast. Dual type polymer electrochromic devices (ECDs) based on P(HMTA-co-Th) and poly(ethylene dioxythiophene) (PEDOT) have been constructed. Spectroelectrochemistry, switching ability and stability of the devices were investigated by UV-vis spectroscopy and cyclic voltammetry. These devices exhibit low switching voltages (between 0.0 V and +1.6 V), short switching times with reasonable switching stability under atmospheric conditions. 相似文献
68.
A new melamine based polymeric sequestering resin was prepared for preconcentration and separation of hexavalent chromium from water, and its sequestering action was investigated. The water-insoluble, cross-linked sequestering resin was formed by reaction with bromosuccinic acid and cross-linking of melamine. The active sequestering group on the resin is NH-(Succinic acid) or salt thereof. The resulting chelating resin was characterized by infrared spectra. The newly prepared resin quantitatively retained Cr(VI) at pH 2.0-4.0 when the flow rate was maintained between 1 and 5 ml min−1. The retained Cr(VI) was instantaneously eluted with 25 ml of 0.1 M NaOH. The chromium species were determined by a flame atomic absorption spectrometer. The limits of detection for Cr(VI) and Cr(III) were found to be 5.3 and 4.2 μg l−1, respectively. The precision and accuracy of the proposed procedure was checked by the use synthetic and reference steel samples. The established preconcentration method was successfully applied to the determination and selective separation of Cr(VI) in electroplating industry wastewater. Total concentrations determined by the spectrophotometric method (110.3±0.6 g l−1 Cr(VI) and 1.2±0.3 g l−1 Cr(III)) are compared with those found by FAAS and the obtained results (110.4±1.8 g l−1 Cr(VI) and 1.4±0.5 g l−1 Cr(III)) show good agreement. 相似文献
69.
A new (E,E)-dioxime, (6Z,7Z)-15,16-dihydro-14H-dibenzo[b,h][1,10,4, 7]dithiadiazacyclotride-cine-6,7(5H,8H)-dionedioxime (H
2
L) has been synthesized by reacting cyanogen-di-N-oxide (2) with 2,2′-[propane-1,3-diylbis(thio)]dianiline (1). Mononuclear complexes (4) and (5) of this ligand have been synthesized by reacting the vic-dioxime (H2L) with NiCl2 · 6H2O and CoCl2 · 6H2O, respectively. The BF
2
+
capped Ni(II) and Co(III) complexes (6) and (7) of the dioxime have been synthesized from (4) and (5). The new compounds were characterized by a combination of elemental analysis, 1H- and 13C-n.m.r, i.r. and m.s. spectral data. 相似文献
70.
Nebojša Banjac Gordana Ušćumlić Nataša Valentić Dušan Mijin 《Journal of solution chemistry》2007,36(7):869-878
Absorption spectra of eight 3-substituted-5,5-diphenylhydantoins have been recorded in fourteen solvents in the range 200–400 nm.
The effect of solvent dipolarity/polarizability and solvent/solute hydrogen bonding interactions are analyzed by means of
the linear solvation energy relationship (LSER) concept proposed by Kamlet and Taft. The lipophilic activity of the investigated
hydantoins was estimated by the calculation of log 10
P values with the Advanced Chemistry Development Software. The calculated values of log 10
P were correlated with the ratio of the contributions of specific solvent interactions, and, by employing the linear dependence
thus obtained, the pharmacological activity of the studied hydantoin derivatives is discussed. 相似文献