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1.
Reza Kordnezhadian Bing-Yu Li Armir Zogu Dr. Joachim Demaerel Prof. Dr. Wim M. De Borggraeve Dr. Ermal Ismalaj 《Chemistry (Weinheim an der Bergstrasse, Germany)》2022,28(60):e202201491
Pentafluorosulfanyl (SF5)-containing compounds and corresponding analogs are a highly valuable class of fluorine-containing building blocks owing to their unique properties. The reason for that is the set of peculiar and tremendously beneficial characteristics they can impart on molecules once introduced onto them. Despite this, their application in distinct scientific fields remains modest, given the extremely harsh reaction conditions needed to access such compounds. The recent synthetic approaches via S−F, and C−SF5 bond formation as well as the use of SF5-containing building blocks embody a “stairway-to-heaven” loophole in the synthesis of otherwise-inaccessible chemical scaffolds only a few years ago. Herein, we report and evaluate the properties of the SF5 group and analogs, by summarizing synthetic methodologies available to access them as well as following applications in material science and medicinal chemistry since 2015. 相似文献
2.
3.
Summary We present an approximation method of a space-homogeneous transport equation which we prove is convergent. The method is very promising for numerical computation. Comparison of a numerical computation with an exact solution is given for the Master equation. 相似文献
4.
Nuclear Magnetic Resonance (NMR) was used to investigate the extrusion behaviour of PTFE pastes in a ram extruder. By means
of 1H-NMR imaging (MRI) it is possible to determine the local proton density and therefore, the local fluid concentration. The
19F-MRI provides the local solid concentration. Thus the local saturation and the local porosity can be calculated with the
information of the local fluid and solid concentration. Furthermore displacement profiles can be derived from NMR images by
means of correlation techniques without any preparation or marking of the pastes.
Received: 8 May 2000 Accepted: 1 May 2001 相似文献
5.
A. Sauer 《Fresenius' Journal of Analytical Chemistry》1873,12(1):32-36
Ohne Zusammenfassung 相似文献
6.
Matrix extensions and eigenvalue completions, the generic case 总被引:2,自引:0,他引:2
William Helton Joachim Rosenthal Xiaochang Wang 《Transactions of the American Mathematical Society》1997,349(8):3401-3408
In this paper we provide new necessary and sufficient conditions for the so-called eigenvalue completion problem.
7.
8.
Regularity of multiwavelets 总被引:7,自引:0,他引:7
The motivation for this paper is an interesting observation made by Plonka concerning the factorization of the matrix symbol associated with the refinement equation for B-splines with equally spaced multiple knots at integers and subsequent developments which relate this factorization to regularity of refinable vector fields over the real line. Our intention is to contribute to this train of ideas which is partially driven by the importance of refinable vector fields in the construction of multiwavelets. The use of subdivision methods will allow us to consider the problem almost entirely in the spatial domain and leads to exact characterizations of differentiability and Hölder regularity in arbitrary L p spaces. We first study the close relationship between vector subdivision schemes and a generalized notion of scalar subdivision schemes based on bi-infinite matrices with certain periodicity properties. For the latter type of subdivision scheme we will derive criteria for convergence and Hölder regularity of the limit function, which mainly depend on the spectral radius of a bi-infinite matrix induced by the subdivision operator, and we will show that differentiability of the limit functions can be characterized by factorization properties of the subdivision operator. By switching back to vector subdivision we will transfer these results to refinable vectors fields and obtain characterizations of regularity by factorization and spectral radius properties of the symbol associated to the refinable vector field. Finally, we point out how multiwavelets can be generated from orthonormal refinable bi-infinite vector fields. 相似文献
9.
We present a systematic comparison of the correlation contribution at the level of the second-order polarization propagator approximation (SOPPA ) and MP 2 to the static dipole polarizability of (1) Be, BeH?, BH, CH+, MgH?, AIH, SiH+, and GeH+; (2) BH3, CH4, NH3, H2O, HF, BF, and F2; and (3) N2, CO, CN?, HCN, C2H2, and HCHO . Fairly extended basis sets were used in the calculations. We find that the agreement with experimental values is improved in SOPPA and MP .2 over the results at the SCF level. The signs and magnitudes of the correlation contribution in SOPPA are similar to those obtained in analytical derivative MP 2 calculations. However, it is not possible to say, in general, which method gives the largest correlation contribution or the best agreement with experiment, nor is it possible to make a priori prediction of the sign of the correlation contribution. For the first group of molecules, which have a quasi-degenerate ground state, additional CCDPPA and CCSDPPA calculations were performed and compared with polarizabilities obtained as analytical/numerical derivatives of the CCD and CCSD energies. The CCSDPPA results were found to be in better agreement with other calculations than were the SOPPA results, demonstrating the necessity of using methods based on infinite-order perturbation theory for these systems. © 1994 John Wiley & Sons, Inc. 相似文献