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211.
Kunal Ghosh Subirnath Bhattacharyya Purnendranath Sen 《International journal of quantum chemistry》1970,4(4):347-353
The charge on each atom of some ethers and chloro-substituted ethers, their dipole moments and the quadrupole coupling constants of the chloroethers have been calculated with the method suggested by Del Re. There appears to be an intimate connection between the charge density on the oxygen atoms and the capacity of forming hydrogen bond. 相似文献
212.
Brajagopal Samanta Joy Chakraborty Nirmal Kumar Karan R. K. Bhubon Singh Glean P. A. Yap Christoph Marschner Judith Baumgartner Samiran Mitra 《Structural chemistry》2006,17(1):139-147
Two new cyano-bridged trinuclear heterometallic complexes [Sr2(Phen)4(CF3CO2)(H2O)3Fe(CN)6]·2H2O (1) [Ca2(Phen)4(CF3CO2)(H2O)Co(CN)6]·2H2O (2) (where Phen=1,10-phenanthroline) have been synthesized and their crystal structures have been determined. The structure of complex (1) features a central [Fe(CN)6]3− unit that links a monocation, [Sr(Phen)2(OH2)(OOCCF3)]+ and a dication, [Sr(Phen)2(OH2)2]2+ via two trans cyanide bridges. The complex (2) features a central [Co(CN)6]3− unit that links two monocations of [Ca(Phen)2(OH2)(OOCCF3)]+ (the positions of the trifluoro acetate and water molecules are disordered over two positions) via two trans cyanide bridges. Each metal atom is seven coordinated and achieves pentagonal bipyramidal geometry. Two cocrystallized water molecules are present in both the complexes. The presence of an extensive network of hydrogen bonding imparts the overall stability to both the systems. 相似文献
213.
214.
Kamar KK Das S Hung CH Castiñeiras A Kuz'min MD Rillo C Bartolomé J Goswami S 《Inorganic chemistry》2003,42(17):5367-5375
A new polydentate bridging ligand, NH(4)C(5)N=NC(6)H(4)N(H)C(5)H(4)N (HL(2)), is synthesized by the cobalt-mediated phenyl ring amination of coordinated NH(4)C(5)N=NC(6)H(5). The green cobalt complex intermediate [Co(L(2))(2)](ClO(4)), [1](ClO(4)), and the free ligand HL(2) were isolated and characterized. The X-ray structure of [H(2)L(2)](ClO(4)) is reported. The ligand, upon deprotonation, behaves as a bridging ligand. It reacts with NiCl(2).6H(2)O and Na(2)[PdCl(4)] to produce dimetallic complexes, [Ni(2)Cl(2)(L(2))(2)], 2, and [Pd(2)(L(2))(2)](ClO(4))(2), [3](ClO(4))(2), respectively. X-ray structures of these two dimetallic complexes are reported. The structure of the dinickel complex, in particular, is unique. In this complex, the two deprotonated secondary amine nitrogens of the two [L(2)](-) ligands bind to two nickel centers simultaneously forming a planar Ni(2)N(2) arrangement. The complex [3](ClO(4))(2) is diamagnetic while the complex 2 is paramagnetic. The results of magnetic measurements on the dinickel complex in the temperature range 1.8-300 K are reported. The system can be described as a single spin S = 2 in the low-temperature range T < J/k whereas at high temperatures, T > J/k, it behaves as two independent spins S = 1.The reaction of [L(2)](-) with K(2)[PtCl(4)], however, yielded a monometallic platinum complex, [PtCl(3)(L(2))], 5, where the pyridyl nitrogen of the aminopyridyl function remained unused. The X-ray structure of the complex 4a is reported. The bond lengths along the ligand backbones in all the complexes indicate extensive pi-delocalization. Spectral data of the complexes are reported and compared. 相似文献
215.
Linchon B. Mehta Kunal K. Wadgaonkar 《Journal of Dispersion Science and Technology》2019,40(5):756-765
The present work focuses on the ability of 2-hydroxyethyl methacrylate (HEMA), isobornyl methacrylate (IBOMA) and methyl methacrylate (MMA) as reactive diluents to replace styrene in unsaturated polyester resin based on itaconic acid, sebacic acid, 1,4-Butanediol, 1,6-Hexanediol and glycerol. The structural analysis confirmed the presence of itaconate linkages in the UPs. The synthesized resins were characterized by infrared spectroscopy and their physiochemical properties such as appearance, viscosity, acid value, %volatile content, curing characteristics like gel time, peak exotherm temperature and total cure time. Among all the resins formed; the resin based on 1,6-Hexanediol showed optimum molecular weight and viscosity needed for final application. The cured resins were investigated for their thermal stability by thermo-gravimetric analysis which revealed that all the diluted resins had good thermal stability. From the results it could be concluded that styrene-free bio-based unsaturated polyester resin can be synthesized having properties equivalent to the commercial styrene based resin.GRAPHICAL ABSTRACT 相似文献
216.
Kunal V. Gujraty Mallinamadugu J. Yanjarappa Arundhati Saraph Amit Joshi Jeremy Mogridge Ravi S. Kane 《Journal of polymer science. Part A, Polymer chemistry》2008,46(21):7249-7257
We describe the synthesis of activated homopolymers and copolymers of controlled molecular weight based on the controlled radical polymerization of N‐acryloyloxysuccinimide (NAS) by reversible addition fragmentation chain transfer (RAFT). We synthesized activated homopolymers in a range of molecular weights with polydispersities between 1 and 1.2. The attachment of an inhibitory peptide to the activated polymer backbone yielded a potent controlled molecular weight polyvalent inhibitor of anthrax toxin. To provide greater control over the placement of the peptides along the polymer backbone, we also used a semibatch copolymerization method to synthesize copolymers of NAS and acrylamide (AAm). This approach enabled the synthesis of copolymers with control over the placement of peptide‐reactive NAS monomers along an inert backbone; subsequent functionalization of NAS with peptide yielded well‐defined polyvalent anthrax toxin inhibitors that differed in their potencies. These strategies for controlling molecular weight, ligand density, and ligand placement will be broadly applicable for designing potent polyvalent inhibitors for a variety of pathogens and toxins and for elucidating structure–activity relationships in these systems. © 2008 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 46: 7249–7257, 2008 相似文献
217.
N. K. Karan R. S. Katiyar T. Maiti R. Guo A. S. Bhalla 《Journal of Raman spectroscopy : JRS》2009,40(4):370-375
This paper reports a systematic study of the composition and the temperature‐dependent‐Raman spectra of Zr4+‐rich BaZrxTi1−xO3 (BZT) ceramic compositions (0.50⩽x⩽1.00). On the basis of the dielectric behavior of Zr rich BZT ceramics, the observed relaxor behavior has been hypothesized as a result of increasing long‐range interactions of nanosized, Ti4+‐rich polar regions in a Zr4+‐rich nonpolar matrix. Beyond an optimum concentration of BaTiO3 (BT) in the nonpolar matrix of BaZrO3 (x⩽0.75), a critical size and density of the polar regions is reached when the polar clusters start showing the relaxor like behavior, which finally show classical relaxor behavior for compositions with x = 0.5 and 0.6. This hypothesis is strongly supported from the Raman data on Zr‐rich BZT presented in this paper. Well‐defined BT Raman spectra for 5% BT in BZT composition were recorded, which followed completely up to the 50% Ti addition in the BZT samples. The temperature‐dependent Raman spectra collected on the BZT ceramics far beyond the dielectric transition temperatures supported the existence of the nano‐polar BT regions, like in typical relaxor samples. The full width at half‐maximum (FWHM), integrated intensity of the peaks in the Raman spectra has been analyzed to further support the conclusions. Copyright © 2008 John Wiley & Sons, Ltd. 相似文献
218.
We consider the Green function appropriate for weak plasma turbulence and show that, after a sufficiently long time, it approaches the Green function for a Markovian system. 相似文献
219.
220.
Strong frequency-dependent fluid flow has been observed near the surface of microelectrode arrays. Modeling this phenomenon has proven to be difficult, with existing theories unable to account for the qualitative trend observed in the frequency spectra of this flow. Using recent electrode polarization results, a more comprehensive model of the double layer on the electrode surface is used to obtain good theoretical agreement with experimental data. Copyright 2001 Academic Press. 相似文献