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http://dx.doi.org/10.1021/cr200133c | DOI Listing |
Chem Sci
October 2024
State Key Laboratory of Structural Chemistry, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences Fuzhou 350002 P. R. China
Balancing the critical property requirements is key to surmounting the obstacles in the application of nonlinear optical (NLO) crystals. Tricoordinated units, characterized by nearly the lowest coordination number, are common in inorganic NLO-active oxides; however, crystals solely composed of such units are rare. Herein, by assembling three distinct tricoordinated units (SbO, TeO, and NO) into a single crystal, a pioneering fully tricoordinated NLO material, (SbTeO)(NO), was synthesized a facile volatilization method.
View Article and Find Full Text PDFDalton Trans
June 2024
Department of Applied Chemistry, Faculty of Science and Engineering, Chuo University, 1-13-27 Kasuga, Bunkyo-ku, Tokyo 112-8551, Japan.
Phys Chem Chem Phys
October 2023
Department of Chemistry, Faculty of Science, Tokyo Metropolitan University, 1-1 Minami-Osawa, Hachioji-Shi, Tokyo 192-0397, Japan.
L-Glutamic acid (Glu) plays a pivotal role in amino acid metabolism in living organisms. Theoretical knowledge of how metabolism propagates the nitrogen isotope composition (δN) is essential for elucidating the mechanism of amino acid metabolism . In this paper, to estimate the nitrogen isotope fractionation involving Glu and its protonated/deprotonated species, their nitrogen isotopic reduction partition function ratios (RPFRs) were calculated at the apfd/6-311+G(2d,p) level of theory by the SCRF method.
View Article and Find Full Text PDFJ Am Soc Mass Spectrom
April 2023
Sterling Chemistry Laboratory, Yale University, New Haven, Connecticut 06520, United States.
The formation of isomers when trapping floppy cluster ions in a temperature-controlled ion trap is a generally observed phenomenon. This involves collisional quenching of the ions initially formed at high temperature by buffer gas cooling until their internal energies fall below the barriers in the potential energy surface that separate them. Here we explore the kinetics at play in the case of the two isomers adopted by the H(HO) cluster ion that differ in the proton accommodation motif.
View Article and Find Full Text PDFInorg Chem
January 2023
Departamento de Química Inorgánica, Facultad de Química, Universidad de Murcia, Campus de Espinardo, 30100 Murcia, Spain.
The reactions leading to the formation of C-heteroatom bonds in the coordination sphere of Au(III) complexes are uncommon, and their mechanisms are not well known. This work reports on the synthesis and reductive elimination reactions of a series of Au(III) methyl complexes containing different Au-heteroatom bonds. Complexes [Au(CF)(Me)(X)(PR)] (R = Ph, X = OTf, OClO, ONO, OC(O)CF, F, Cl, Br; R = Cy, X = Me, OTf, Br) were obtained by the reaction of -[Au(CF)(Me)(PR)] (R = Ph, Cy) with HX.
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