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1.
John Spencer Christine B. BaltusNeil J. Press Ross W. HarringtonWilliam Clegg 《Tetrahedron letters》2011,52(31):3963-3968
Boc-protected (piperazin-1-ylmethyl)biaryls have been synthesised from (Boc-piperazin-1-ylmethyl)phenylboronic acid pinacol esters via a microwave-mediated Suzuki-Miyaura coupling with aryl bromides viz. 1-bromo-, 2-, 3- or 4-nitrobenzene or 2-bromo-5-nitropyridine. Judicial removal of the protecting group on the piperazine, or facile reduction of the nitro group on the biaryl system enabled the manipulation of two points of functionality in order to diversify the scope of the resulting biaryl library. 相似文献
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Azizolla Beheshti William Clegg Sophie H. Dale Reza Hyvadi 《Acta Crystallographica. Section C, Structural Chemistry》2009,65(9):m331-m332
The title complex, (C24H20P)2[WZnS4(S6)]·C3H6O or (Ph4P)2[WS2(μ‐S)2{Zn(S6)}]·Me2CO, was unexpectedly obtained on attempted recrystallization of a mixed tungten–zinc complex of a tris(pyrazolato)borate ligand. The two metal centres of the anion have distorted tetrahedral coordination and the two tetrahedra share one S...S edge; tungsten is additionally coordinated by two terminal sulfide ligands and zinc by a chelating S62− ligand, which has one central S—S bond significantly longer than the other four, a pattern found to be consistent for this ligand. This is the first reported example of a tetrahedral zinc centre bridging an edge of a single tetrathiotungstate(VI) or tetrathiomolybdate(VI) anion, although there are many previous examples with other metals. 相似文献
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Joseph A. Rard Ananda M. Wijesinghe Simon L. Clegg 《Journal of solution chemistry》2010,39(12):1845-1864
Clegg, Pitzer, and Brimblecombe (J. Phys. Chem. 96:9470–9479, 1992) described a thermodynamic model for representing the activities of solutes and a solvent, for a single electrolyte and for
mixtures of arbitrary complexity, which is valid to very high concentrations including electrolytes approaching complete mutual
solubility. This model contains a Debye-Hückel term along with two ionic-strength-dependent virial terms and a Margules expansion
in the mole fractions of the components at the four-suffix level, with ionic strengths expressed on the mole-fraction composition
scale. This model is an extension of earlier work by Pitzer and Simonson (J. Phys. Chem. 90:3005–3009, 1986). However, Pitzer’s molality-based ion-interaction model (Activity Coefficients in Electrolyte Solutions, 2nd edn., CRC Press,
1991) is more commonly used for thermodynamic modeling calculations. In this paper we recast the Margules expansion terms of the
mole-fraction-based model equations for a single electrolyte in a single solvent into simpler virial expansions in powers
of the mole-fraction-based ionic strength. We thereby show that these reformulated equations are functionally analogous to
those of Pitzer’s standard ion-interaction model with an additional virial term added that is cubic in the ionic strength.
By using a series of algebraic transformations among composition scales, we show that the pairs of terms involving the BM,X(1)B_{\mathrm{M,X}}^{(1)} and the BM,X(2)B_{\mathrm{M,X}}^{(2)} parameters in the original mole-fraction-based model expression for the natural logarithm of the mean activity coefficient
(and consequently for the excess Gibbs energy) differ from each other only by a simple numerical factor of −2 and, therefore,
these four terms can be replaced by two terms yielding simpler expressions. Test calculations are presented for several soluble
electrolytes to compare the effectiveness of the reformulated mole-fraction- and molality-based models, at the same virial
level in powers of ionic strength, for representing activity data over different ionic strength ranges. The molality-based
model gives slightly better fits over the ionic strength range 0 mol⋅kg−1≤I≤6 mol⋅kg−1, whereas the mole-fraction-based model is generally better for more extended ranges. 相似文献
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Amitabha Datta Jui-Hsien Huang Jack K. Clegg Pei-Hsin Liu Sheng-Jie Chuang 《Central European Journal of Chemistry》2013,11(1):116-122
A tridentate hydrazone precursor, N′-[1-(pyridin-2-yl)ethylidene]acetohydrazide (L) (1:1 refluxed product of acetichydrazide and 2-acetylpyridine), produced two octahedral CuII and NiII derivatives, [CuL2]·NO3 (1) and [NiL2]·ClO4·H2O (2). Both are subjected to X-ray diffraction system, and structural investigation shows that the central metal atom (CuII or NiII) adopts a distorted octahedral geometry with N4O2 donor sets by coordination of a pair of independent hydrazone precursors. Besides X-ray study, IR and UV-vis spectra, thermal analysis and room temperature magnetic moments are utilized for establishing significant characteristics of both complexes. It is apparent that the M-Npyridine bonds are slightly longer than the M-Nimino bonds, Cu1-N1 and Cu1-N4 [2.300(2) and 2.038(2) ?] for 1 and Ni1-N1 and Ni1-N4 [2.075(2) and 2.084(1) ?] for 2, Cu1-N2 and Cu1-N5 [2.062(1) and 1.932(1) ?] for 1 and Ni1-N2 and Ni1-N5 [2.008(2) and 1.975(2) ?] for 2, respectively. As per our observation, the effective magnetic moment value (μeff) is found to be 1.77 B.M. for 1 and 3.06 BM for 2, respectively. 相似文献
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