Powder diffraction data of dibromidodioxido-[(4,4′-di-tert-butyl)-2,2′-bipyridine]molybdenum(VI) (C18H24Br2MoN2O2)

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Názov: Powder diffraction data of dibromidodioxido-[(4,4′-di-tert-butyl)-2,2′-bipyridine]molybdenum(VI) (C18H24Br2MoN2O2)
Autori: Julián F. Torrado G., Cristhian C. Álvarez, Oscar Rodríguez B., Jose G. Carriazo, Nelson J. Castellanos
Zdroj: Powder Diffraction. :1-8
Informácie o vydavateľovi: Cambridge University Press (CUP), 2025.
Rok vydania: 2025
Popis: This work reports the X-ray powder diffraction (XRPD) data recorded at room temperature (293 K) of dibromidodioxido-[(4,4′-di-tert-butyl)-2,2′-bipyridine]molybdenum(VI). The analysis of the powder diffraction pattern led to an orthorhombic united cell with parameters a = 17.9205(23) Å, b = 13.4451(16) Å, c = 18.1514(19) Å, V = 4,373.5(11) Å3, and values of Z = 8 and Z’ = 2. The crystal structure of this material corresponds to the structure of entry IFUJEC of the Cambridge Structural Database (CSD), determined at 90 K. The excellent Rietveld refinement, carried out with General Structure and Analysis Software II (GSAS-II), showed the single-phase nature of the material and the good quality of the data. This material was also characterized by elemental analysis, UV–vis, Fourier transform infrared spectroscopy (FTIR), and proton nuclear magnetic resonance (1H-NMR) techniques.
Druh dokumentu: Article
Jazyk: English
ISSN: 1945-7413
0885-7156
DOI: 10.1017/s088571562510078x
Rights: Cambridge Core User Agreement
Prístupové číslo: edsair.doi...........c65ffc5d9672c009063e8feee9bf8cc2
Databáza: OpenAIRE
Popis
Abstrakt:This work reports the X-ray powder diffraction (XRPD) data recorded at room temperature (293 K) of dibromidodioxido-[(4,4′-di-tert-butyl)-2,2′-bipyridine]molybdenum(VI). The analysis of the powder diffraction pattern led to an orthorhombic united cell with parameters a = 17.9205(23) Å, b = 13.4451(16) Å, c = 18.1514(19) Å, V = 4,373.5(11) Å3, and values of Z = 8 and Z’ = 2. The crystal structure of this material corresponds to the structure of entry IFUJEC of the Cambridge Structural Database (CSD), determined at 90 K. The excellent Rietveld refinement, carried out with General Structure and Analysis Software II (GSAS-II), showed the single-phase nature of the material and the good quality of the data. This material was also characterized by elemental analysis, UV–vis, Fourier transform infrared spectroscopy (FTIR), and proton nuclear magnetic resonance (1H-NMR) techniques.
ISSN:19457413
08857156
DOI:10.1017/s088571562510078x