X-ray diffractive imaging of controlled gas-phase molecules reveals the molecular structure of 2,5-diiodothiophene

Scilight ◽  
2020 ◽  
Vol 2020 (9) ◽  
pp. 091106
Author(s):  
Jodi Ackerman Frank
2020 ◽  
Vol 152 (8) ◽  
pp. 084307 ◽  
Author(s):  
Thomas Kierspel ◽  
Andrew Morgan ◽  
Joss Wiese ◽  
Terry Mullins ◽  
Andy Aquila ◽  
...  

2008 ◽  
Vol 63 (3) ◽  
pp. 275-279 ◽  
Author(s):  
Bernd Wrackmeyer ◽  
Ezzat Khan ◽  
Rhett Kempe

Protodeborylation of triorganoboranes, usually carried out under mild reaction conditions using an excess of acetic acid, affords 1,5-dialkyl-3,7-dimethyl-4,8,9-trioxa-2,6-dioxonia-1,5-diboratabicyclo [3.3.1]nona-2,6-dienes OB(R)OC(Me)OB(R)OC(Me)O [1 (R = Et), 2 (R = cyclooctyl)]. Acetoxy(dialkyl) boranes and di(acetoxy)alkylboranes were not formed in an appreciable amount. Compounds 1 and 2 were characterized by NMR spectroscopy (1H, 11B, 13C NMR) in solution, the molecular structure of 2 was determined by X-ray analysis. The gas-phase geometry of 1 was optimized by calculations [B3LYP/6-311+G(d, p) level of theory], and its NMR parameters were also calculated at the same level of theory.


2014 ◽  
Vol 112 (8) ◽  
Author(s):  
Jochen Küpper ◽  
Stephan Stern ◽  
Lotte Holmegaard ◽  
Frank Filsinger ◽  
Arnaud Rouzée ◽  
...  

2014 ◽  
Vol 171 ◽  
pp. 57-80 ◽  
Author(s):  
Rebecca Boll ◽  
Arnaud Rouzée ◽  
Marcus Adolph ◽  
Denis Anielski ◽  
Andrew Aquila ◽  
...  

This paper gives an account of our progress towards performing femtosecond time-resolved photoelectron diffraction on gas-phase molecules in a pump–probe setup combining optical lasers and an X-ray free-electron laser. We present results of two experiments aimed at measuring photoelectron angular distributions of laser-aligned 1-ethynyl-4-fluorobenzene (C8H5F) and dissociating, laser-aligned 1,4-dibromobenzene (C6H4Br2) molecules and discuss them in the larger context of photoelectron diffraction on gas-phase molecules. We also show how the strong nanosecond laser pulse used for adiabatically laser-aligning the molecules influences the measured electron and ion spectra and angular distributions, and discuss how this may affect the outcome of future time-resolved photoelectron diffraction experiments.


2021 ◽  
Vol 9 ◽  
Author(s):  
Ali Bumajdad ◽  
Shamsun Nahar ◽  
Mohamed I. Zaki

The test alumina (the so-called ι-Al2O3) was thermally recovered at 1,100°C from chitosan-AlOx hybrid films and found to contain Na and Ca impurity ions inherited from the parent chitosan. Two different modifications of pure alumina, namely, γ- and α-Al2O3, were adopted as control samples. The test and control aluminas were examined for 1) the bulk elemental constitution by atomic absorption spectroscopy (AAS), 2) the surface chemical composition by X-ray photoelectron spectroscopy (XPS), 3) the bulk phase composition by X-ray powder diffractometry (XRD), ex-situ Fourier-transform infrared spectroscopy (IR), and Laser Raman (LRa) spectroscopy, 4) the surface area, topography, and morphology by N2 sorptiometry, and atomic force (AFM) and scanning electron microscopy (SEM), 5) the surface adsorptive interactions with pyridine and 2-propanol gas-phase molecules by in-situ IR spectroscopy of the adsorbed species, and 6) the surface catalytic interactions with 2-propanol gas-phase molecules by in-situ IR spectroscopy of the gas phase. Results obtained could clearly show that the test alumina (ι-Al2O3) is only hypothetically pure alumina since in reality its bulk structure is majored by mullite-type Na-aluminate (Na0.67Al6O9.33/NaAlO2) and minored by Na-β-alumina (Na1.71Al11O17) and β-alumina (NaAl11O17). Consistently, observed Na-influenced modifications of the surface chemistry, topology, and morphology, as well as adsorptive and catalytic interactions with pyridine and 2-propanol gas-phase molecules, showed significant deviations from those exhibited by the control pure aluminas (γ- and α-Al2O3).


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