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991.
992.
Aihara H Alston-Garnjost M Avery RE Barbaro-Galtieri A Barker AR Barnett BA Bauer DA Bay A Bobbink GJ Buchanan CD Buijs A Caldwell DO Chao HY Chun SB Clark AR Cowan GD Crane DA Dahl OI Daoudi M Derby KA Eastman JJ Eberhard PH Edberg TK Eisner AM Erné FC Fairfield KH Hauptman JM Hofmann W Hylen J Kamae T Kaye HS Kenney RW Khacheryan S Kofler RR Langeveld WG Layter JG Lin WT Linde FL Loken SC Lu A Lynch GR Madaras RJ Magnuson BD Masek GE Mathis LG Matthews JA Maxfield SJ Miller ES Moses W 《Physical review letters》1990,64(2):172-175
993.
Abachi S Derrick M Kooijman P Musgrave B Price L Repond J Sugano K Blockus D Brabson BB Brom J Jung C Ogren H Rust DR Snyder A Cork B Akerlof C Chapman J Errede D Ken MT Kesten P Meyer DI Neal H Nitz D Thun R Tschirhart R Baringer P Bylsma BG Debonte R Low EH McIlwain RL Miller DH Ng CR Rangan K Shibata E 《Physical review D: Particles and fields》1990,41(7):2045-2056
994.
Bowcock T Kinoshita K Pipkin FM Procario M Wilson R Wolinski J Xiao D Ammar R Baringer P Coppage D Haas P Lam H Jawahery A Park CH Kubota Y Nelson JK Perticone D Poling R Chen W Dominick J McIlwain RL Miller DH Ng CR Schaffner SF Shibata EI Yao W Sparks K Thorndike EH Alam MS Kim IJ Li WC Lou XC Sun CR Fulton R Hempstead M Jensen T Johnson DR Kagan H Kass R Morrow F Whitmore J Bortoletto D Goldberg M Horwitz N Mestayer MD Moneti GC Sharma V Shipsey IP Skwarnicki T Csorna SE Letson T Alexander J 《Physical review D: Particles and fields》1990,41(3):805-808
995.
Summary Thep-tert-butylcalix[n]arenes (n=4,6,7,8) andp-tert-butyldihomooxacalix[4]arene have been separated by reverse phase liquid chromatography. Optimum conditions have been obtained on a Spherisorb ODS1, 5 m C18 column by isocratic ambient elution with acetonitrile-methyltert-butyl ether. Calibration plots have been obtained from purified calixarenes and the reliability of the method is confirmed from test mixtures of calixarenes of known composition. 相似文献
996.
9,10-Phenanthrenequinone and acenaphthenequinone are shown to act as simple redox-dependent receptors toward aromatic ureas in CH(2)Cl(2) and DMF. Reduction of the o-quinones to their radical anions greatly increases the strength of hydrogen bonding between the quinone carbonyl oxygens and the urea N-hydrogens. This is detected by large positive shifts in the redox potential of the quinones with no change in electrochemical reversibility upon addition of urea guests. Cyclic voltammetric studies with a variety of possible guests show that the effect is quite selective. Only guests with two strong hydrogen donors, such as O-H bonds or amide N-H bonds, that are capable of simultaneously interacting with both carbonyl oxygens give large shifts in the redox potential of the quinones. The electronic character and conformational preference of the guest are also shown to significantly affect the magnitude of the observed potential shift. In the presence of strong proton donors the electrochemistry of the quinone becomes irreversible indicating that proton transfer has taken place. Experiments with compounds of different acidity show that the pK(a) of the protonated quinone radical is about 15 on the DMSO scale, >4 pK(a) units smaller than that of 1,3-diphenylurea. This is further proof that hydrogen bonding and not proton transfer is responsible for the large potential shifts observed with this and similar guests. 相似文献
997.
We have used the ring-polymer molecular dynamics method to calculate approximate Kubo-transformed velocity autocorrelation functions and self-diffusion coefficients for low-pressure liquid para-hydrogen at temperatures of 25 and 14 K. The resulting diffusion coefficients are shown to be consistent with experimental shear viscosities and the established finite-size relation D(L) approximately = D(infinity)-2.837k(B)T6pietaL, where k(B) is the Boltzmann constant, T the absolute temperature, eta the shear viscosity, and L the length of the (cubic) simulation cell. The diffusion coefficients D(L) obtained in simulations with finite system sizes are therefore too small. However, the extrapolation to infinite system size corrects this deficiency and leads to excellent agreement with experimental results. This both demonstrates the influence of system-size effects on quantum mechanical diffusion coefficients and provides further evidence that ring-polymer molecular dynamics is an accurate as well as practical way of including quantum effects in condensed phase molecular dynamics. 相似文献
998.
Pappenfus TM Chesterfield RJ Frisbie CD Mann KR Casado J Raff JD Miller LL 《Journal of the American Chemical Society》2002,124(16):4184-4185
A terthiophene-based quinodimethane, 3',4'-dibutyl-5,5' '-bis(dicyanomethylene)-5,5' '-dihydro-2,2':5',2' '-terthiophene (1) was synthesized and crystallized. Compound 1 has a planar quinoid geometry that is stabilized by dicyanomethylene groups at each end of the molecule. In the crystal each molecule is part of a dimerized face-to-face pi-stack, with intermolecular spacings of 3.47 and 3.63 A, respectively. Cyclic voltammetry showed that 1 could be reversibly reduced and oxidized in methylene chloride solution. Thin film transistors (TFTs) were prepared by vacuum evaporation of 1 onto SiO2(300 nm)/Si substrates, followed by evaporation of Ag source and drain contacts. The doped Si substrate served as the gate electrode. X-ray diffraction and atomic force microscopy indicate the films are polycrystalline, with the long axes of the molecules approximately perpendicular to the substrate. The TFT measurements revealed n-channel conduction in films of 1, with room-temperature electron field effect mobilities as high as 0.005 cm2/Vs. The butyl side chains give 1 appreciable solubility in a range of common solvents, and preliminary TFT results on films cast from chlorobenzene show electron mobility as high as 0.002 cm2/Vs. These results indicate that pi-stacked quinoidal thiophene oligomers are a promising new class of soluble n-channel organic semiconductors. 相似文献
999.
[reaction: see text] Highly regioselective, catalytic asymmetric reductive coupling reactions of 1,3-enynes and ketones have been achieved using catalytic amounts of Ni(cod)(2) and a P-chiral, monodentate ferrocenyl phosphine ligand. These couplings represent the first examples of catalytic, intermolecular reductive coupling of alkynes and ketones, enantioselective or otherwise, and afford synthetically useful 1,3-dienes possessing a quaternary carbinol stereogenic center in up to 70% ee. 相似文献
1000.
The crystal structure of cobalt orthophosphate has been refined by full-matrix least-squares procedures using automatic diffractometer data to a residual R = 0.039 (Rw = 0.058). The space group is , with a = 5.063(1), b = 8.361(2), c = 8.788(2) Å, and β = 121.00(2)°. Co3(PO4)2 is isotypic with the previously reported γ-Zn3(PO4)2 and Mg3(PO4)2. Cobalt ions occupy two distinct coordination polyhedra, one five and one six-coordinated, in a ratio of two to one. The structure is described in detail. 相似文献