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31.
Summary Procedures were developed for the preparation of the 2-, 3-, 4-, and 6-monosubstituted chloro and bromo 8-quinolinols which afforded greater yields and/or reduced the number of steps in the preparation. 100 MHz1H-NMR spectra for the 12 possible monochloro and monobromo analogues are given.
Verbesserte Synthese von Monochlor- und Monobrom-8-chinolinolen
Zusammenfassung Es wurden Verfahren entwickelt, um 2-, 3-, 4- und 6-Chlor bzw. -Brom-8-chinolinole in besseren Ausbeuten und/oder bei reduzierter Anzahl von Synthesestufen herzustellen. Die1H-NMR-Spektren der 12 möglichen Monochlor- und Monobromverbindungen werden angegeben.相似文献
32.
Herman MF 《The journal of physical chemistry. A》2005,109(41):9196-9205
The derivation of a semiclassical surface hopping procedure from a formally exact solution of the Schrodinger equation is discussed. The fact that the derivation proceeds from an exact solution guarantees that all phase terms are completely and accurately included. Numerical evidence shows the method to be highly accurate. A Monte Carlo implementation of this method is considered, and recent work to significantly improve the statistical accuracy of the Monte Carlo approach is discussed. 相似文献
33.
Frank J. Quaeyhaegens Herman O. Desseyn Spiros P. Perlepes John C. Plakatouras Ben Bracke Albert T. H. Lenstra 《Transition Metal Chemistry》1991,16(1):92-101
Summary The synthesis of the NiII, PdII and CuII complexes of N, N-bis(aminoalkyl)oxamides (LH2) is described and structures are proposed on the basis of their physical and spectroscopic properties. With NiII and PdII only one complex is formed with general formula NiL or PdL, characterised by coordination through two deprotonated amide N-atoms and two terminal NH2 groups. With CuII it proved possible to obtain three structurally different compounds, depending on the pH, with general formulae Cu(LH2)X2, Cu2(L)X2 and CuL in which X=Cl, Br or NO3. The structure of [Cu2(C8O2N4H16](NO3)2 was solved by means ofx-ray diffraction; Mr=451.33, monoclinic, space group P21/n, a=9.503(4), b=7.614(1), c=10.407(3) Å, =98.43(3)°, V=744.3(7)Å3, Z=2, Dx=1.202 g cm–3, =1.33 cm–1, (MoK)=0.71073 Å, F(000)=520, room temperature, R=0.043, wR=0.047 for 1080 observed [I>-3(I)] not systematically absent reflections out of 1423 measurements and 137 variables. The compound has a conformational chair/boat disorder with 82% in the more stable chair form. 相似文献
34.
Codée JD Litjens RE den Heeten R Overkleeft HS van Boom JH van der Marel GA 《Organic letters》2003,5(9):1519-1522
Diphenylsulfoxide in combination with triflic anhydride provides a very potent thiophilic glycosylation promotor system, capable of activating disarmed thioglycosides. The usefulness of this novel thiophilic activator is illustrated in a successful chemoselective glycosylation sequence in which the donor thioglycoside in the first condensation step may be either armed or disarmed. [reaction: see text] 相似文献
35.
Determination of valepotriates 总被引:2,自引:0,他引:2
In this paper an overview is given of qualitative and quantitative methods of analysis used for valepotriates. Methods like spectophotometry, titrimetry, TLC, GC, HPLC, MS, CE as well as p-SFC have been applied. Today HPLC is the method of choice. The usefulness of the individual methods are discussed. 相似文献
36.
Abdeloihid Mellouki Robert Georges Michel Herman Deanne L. Snavely Svetlana Leytner 《Chemical physics》1997,220(3):443-322
We have recorded the infrared absorption spectrum of pyrrole at 0.005 cm−1 spectral resolution using a Fourier transform interferometer. The rotational analysis of the fundamental N---H stretch (110) at 3530.811343(82) cm−1 was performed. A set of 13 upper state rovibrational parameters was determined, allowing the 2715 assigned rovibrational lines to be reproduced with a standard deviation of 1.3 10−3 cm−1. An attempt to record the fundamental band under slit-jet conditions is reported. The role of hot bands accompanying the series of the N---H stretch excitation is investigated. Effective vibrational parameters — ω01, X011, Y111, X1,24 — are obtained. The lower level in the hot band series is unambiguously identified as the V24 = 1 level, by retrieving X1,24 independently, from other spectral data. The observation of the complex band pattern accompanying the N---H series in the higher overtone range is discussed with the help of new data, recorded around the 150 band at different temperatures using intracavity laser optoacoustic spectroscopy. 相似文献
37.
38.
Summary After a brief introduction of the subject, the paper focusses on the first step in any optimization procedure: the delineation
of the parameter space, wherein the global optimum is to be found. For organic modifier optimization in reversed-phase liquid
chromatography it is shown that the necessary information can be derived from a single water-methanol gradient. It first yields
an estimate of the total number of solutes in the sample, which is vital to define the peak capacity needed to achieve separation
at a certain confidence level. Next, the gradient allows the prediction of suitable isocratic methanol binary solvents, and
transfer rules formulate the iso-eluotropic composition of the common binary solvents (tetrahydrofuran and acetonitrile).
Because all predictions are based on a statistical analysis of a limited data base, attention is given to the practical situation
where an actual sample deviates from the average solute behaviour. Such deviations are revealed in the first isocratic run
and can be used to arrive at a better estimate of solute retention. 相似文献
39.
Ola Bratteli George A. Elliott Richard H. Herman 《Communications in Mathematical Physics》1980,74(3):281-295
A simpleC*-algebra and a continuous one-parameter automorphism group are constructed such that the set of inverse temperatures at which there exist equilibrium states (i.e., KMS states, or, for =±, ground or ceiling states) is an arbitrary closed subset of IR{±}.With partial support of the National Science Foundation 相似文献
40.
Contributions to the Chemistry of Silicon-Sulphur Compounds. 46. 29Si-N.M.R. Chemical Shifts of Trialkoxysilylthio Derivatives of Permethylpolysilanes 29Si-N.M.R. chemical shifts of trialkoxysilythio derivatives of permethylpolysilanes of the two series: α, ω-(RO)3SiS(SiMe2)nSSi(OR)3, n = 2, 3, 4, 6 and 1-(RO)3SiS(SiMe2)nMe, n = 2, 4; R = i-Pr, t-Bu and also 31C-NMR shifts are given. The relationship of 29Si-NMR chemical shift from the netto charge at the silicon atom q(Si) which value has been corrected according to the Sandorfy C quantum-chemical model is discussed. The greater reduction of the electron density at silicon in compounds with Si? X bond (X = S, P, Cl) has been explained by a conjugation of the lone of sulphur with the Si? X bonding pair. 相似文献