2013
DOI: 10.1021/jp3122243
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HCl Adsorption on Copper-Modified ZSM-5: FTIR and DFT Study

Abstract: The adsorption complex of hydrogen chloride on copper-modified ZSM-5 was studied by FTIR and theoretical calculations. The results indicate that the Cl atom of hydrogen chloride is bound to the Cu cations when adsorbed at low pressures (<1 μbar). At higher pressures, HCl adsorbs on the zeolite Brønsted acid sites as well as is hydrogen bonded to the Cu in a larger cluster. Using in situ infrared spectroscopy, we observed a sharp decrease in stretching vibrational frequency of HCl of about 700 cm −1 compared wi… Show more

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Cited by 10 publications
(16 citation statements)
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“…Moreover, a strong absorption band that was centered at 2788 cm −1 is associated with HCl molecules interacting with the siliceous framework. The reduction of the silanol band intensity and the following formation of a broad absorption at 2510 cm −1 have also been reported by Mosallanejad et al for the H-bonding interaction of CuZSM-5 with HCl at room temperature [27]. …”
Section: Resultssupporting
confidence: 70%
See 1 more Smart Citation
“…Moreover, a strong absorption band that was centered at 2788 cm −1 is associated with HCl molecules interacting with the siliceous framework. The reduction of the silanol band intensity and the following formation of a broad absorption at 2510 cm −1 have also been reported by Mosallanejad et al for the H-bonding interaction of CuZSM-5 with HCl at room temperature [27]. …”
Section: Resultssupporting
confidence: 70%
“…These authors underlined that weak protonic acid, such as H 2 S, while inducing an increase in silanol acidity, are not able to provoke the protonation of dimethylpyridine [29,30]. In our very demanding reaction conditions, Bronsted acidity could be due to a fraction of molecularly adsorbed HCl, although the analysis of the high frequency region of the spectra does not clearly reveal such features, as discussed above [25,26,27]. On the other side, HCl can interact with the siliceous framework and we cannot rule out the breaking of some Si–O–Si bond in the mesoporous support, leading to the formation of acidic groups that are able to protonate pyridine.…”
Section: Resultsmentioning
confidence: 89%
“…In addition, an increased intensity of the bands at ca. 2880 and 2475 cm –1 can be ascribed to the strong hydrogen-bonded adduct, −OH···XH, between the Brønsted hydroxyls (Si-(OH)-Al) B and HX leading to proton solvation. ,, Ozin et al, who studied HCl adsorption on the HY zeolite, ascribed the higher-frequency band to red-shifted O–H vibrations and the lower frequency band to red-shifted XH vibrations in the −OH···XH adduct. In their study of HCl adsorption on the SAPO-34 zeotype, Olsbye et al ascribed both bands to the OH vibration in (Si-(OH)-Al) B that is modulated by Fermi resonance effects due to strong hydrogen bonding.…”
Section: Resultsmentioning
confidence: 99%
“…The sample powders were transformed into thin, self-supporting wafers, and transferred into an in situ cell as described in a previous manuscript. 108 Before the adsorption measurements at 30 °C, samples were activated for 30 min at 450 °C under vacuum (vacuum-treated), followed by 30 min in oxygen (oxygen-treated). Subsequent to these treatment processes, NO absorption spectra were obtained over the pressure range of 0.1 μbar to 10 mbar.…”
Section: Methodsmentioning
confidence: 99%