ChemInform Abstract: Some Recent Developments on the Synthesis, Chemical Reactivity, and Theoretical Studies of Tetroxanes

ChemInform ◽  
2013 ◽  
Vol 44 (37) ◽  
pp. no-no
Author(s):  
Nelly L. Jorge ◽  
Alfonso Hernandez-Laguna ◽  
Eduardo A. Castro
Author(s):  
Nelly L. Jorge ◽  
Alfonso Hernández-Laguna ◽  
Eduardo A. Castro

The authors present a review on some recent developments on the synthesis, chemical reactivity and theoretical studies of Tetroxanes analysing their main physical chemistry properties. The authors examine the critical points of the PES of different conformers, and reaction paths at singlet ground state and triplet state of the tetroxane, leader member of the cyclic diperoxide compound family.


2005 ◽  
Vol 902 ◽  
Author(s):  
Nikolay Pertsev

AbstractThe nonlinear thermodynamic theory of epitaxial ferroelectric films has predicted several important strain-induced phenomena, which have been already observed experimentally. This justifies further development of this theory aiming at the better understanding of the structure/property relationships in thin-film ferroelectrics. To that end, a number of new theoretical studies have been performed recently. First, the thermodynamic formalism has been extended to epitaxial films grown on dissimilar substrates inducing anisotropic strains and a shear deformation in the film plane. Second, the polarization states and dielectric properties were calculated for polydomain Pb(Zr1-xTix)O3 films deposited on cubic substrates. Third, the effect of depolarizing field on the physical properties of strained single-domain films sandwiched between continuous electrodes was described. The results of these studies will be discussed in this paper.


RSC Advances ◽  
2017 ◽  
Vol 7 (24) ◽  
pp. 14562-14610 ◽  
Author(s):  
Hatem M. Gaber ◽  
Mark C. Bagley ◽  
Zeinab A. Muhammad ◽  
Sobhi M. Gomha

This review demonstrates the high number of synthetic applications of enaminones in the preparation of acyclic, carbocyclic, heterocyclic and fused heterocyclic compounds.


2011 ◽  
Vol 7 (S281) ◽  
pp. 253-260
Author(s):  
Ken'ichi Nomoto ◽  
Yasuomi Kamiya ◽  
Naohito Nakasato

AbstractWe review some recent developments in theoretical studies on the connection between the progenitor systems of Type Ia supernovae (SNe Ia) and the explosion mechanisms. (1) DD-subCh: In the merging of double C+O white dwarfs (DD scenario), if the carbon detonation is induced near the white dwarf (WD) surface in the early dynamical phase, it could result in the (effectively) sub-Chandrasekhar mass explosion. (2) DD-Ch: If no surface C-detonation is ignited, the WD could grow until the Chandrasekhar mass is reached, but the outcome depends on whether the quiescent carbon shell burning is ignited and burns C+O into O+Ne+Mg. (3) SD-subCh: In the single degenerate (SD) scenario, if the He shell-flashes grow strong to induce a He detonation, it leads to the sub-Chandra explosion. (4) SD-Ch: If the He-shell flashes are not strong enough, they still produce interesting amounts of Si and S near the surface of the C+O WD before the explosion. In the Chandra mass explosion, the central density is high enough to produce electron capture elements, e.g., stable 58Ni. Observations of the emission lines of Ni in the nebular spectra provides useful diagnostics of the sub-Chandra vs. Chandra issue. The recent observations of relatively low velocity carbon near the surface of SNe Ia provide also an interesting constraint on the explosion models.


2019 ◽  
Vol 11 (15) ◽  
pp. 1979-1998 ◽  
Author(s):  
Mehmet Gümüş ◽  
Mehmet Yakan ◽  
İrfan Koca

Thiazoles have attracted much synthetic interest due to their wide variety of biological properties and are important members of heterocyclic compounds. In recent years, studies on the synthesis of thiazole compounds have been increasing because of the properties of this core. In particular, the hybrid structures in which the thiazole ring and the other nuclei are linked have gained popularity. Hybrid structures are formed by the combination of different groups of chemical reactivity and biological activity characteristics. In this review, we highlight recent developments related to hybrid structures containing a thiazole core, recently developed as anticancer, antibacterial, anti-inflammatory, analgesic, anti-tubercular, antialzheimer and antidiabetic compounds.


RSC Advances ◽  
2015 ◽  
Vol 5 (99) ◽  
pp. 80967-80977 ◽  
Author(s):  
Goutam Brahmachari ◽  
Abhishek Kumar ◽  
Ambrish Kumar Srivastava ◽  
Shashi Gangwar ◽  
Neeraj Misra ◽  
...  

One-pot green synthesis and combined spectral and theoretical studies of 2-(4-fluorophenyl)-2-(4-fluorophenylamino)acetonitrile along with its X-ray crystallographic properties are described.


2014 ◽  
Vol 670-671 ◽  
pp. 323-326 ◽  
Author(s):  
Xian Lan Chen ◽  
Na Wu ◽  
Gao Zhang Gou ◽  
Ling Shi ◽  
Shan Qin Pan ◽  
...  

Theoretical studies predicted that doping graphene with nitrogen can tailor its electronic properties and chemical reactivity. We develop here a novel method for synthesis N-doped graphene via solvothermal synthesis process with urea as both reductant and nitrogen sources. The resulting N-doped graphene were characterized by various methods (UV-vis spectra, SEM and XPS). XPS analysis shows a predominant graphitic C 1s peak at ca. 285 eV, an O 1s peak at ca. 532 eV and N 1s peak at ca. 410 eV. Moreover, the atomic ratio of N/C is 5.0% for N-doped graphene, demonstrating nitrogen species have been successfully incorporated into N-doped graphene.


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