X-ray absorption spectroscopy (XAS) has been used to unveil the bromide ion local coordination structure in 1-alkyl-3-methylimidazolium bromide [C(n)mim]Br ionic liquids (ILs) with different alkyl chains. The XAS spectrum of 1-ethyl-3-methylimidazolium bromide has been found to be different from those of the other members of the series, from the butyl to the decyl derivatives, that have all identical XAS spectra. This result indicates that starting from 1-buthyl-3-methylimidazolium bromide the local molecular arrangement around the bromide anion is the same independently from the length of the alkyl chain, and that the imidazolium head groups in the liquid ILs with long alkyl chains assume locally the same orientation as in the [C(4)mim]Br crystal. With this study we show that the XAS technique is an effective direct tool for unveiling the local structural arrangements around selected atoms in ILs. (C) 2011 American Institute of Physics. [doi: 10.1063/1.3625920]

X-Ray absorption spectroscopy investigation of 1-alkyl-3-methylimidazolium bromide salts / D'Angelo, Paola; Zitolo, Andrea; Migliorati, Valentina; Bodo, Enrico; Giuliana, Aquilanti; Louis Hazemann, Jean; Denis, Testemale; Mancini, Giordano; Caminiti, Ruggero. - In: THE JOURNAL OF CHEMICAL PHYSICS. - ISSN 0021-9606. - STAMPA. - 135:7(2011), p. 074505. [10.1063/1.3625920]

X-Ray absorption spectroscopy investigation of 1-alkyl-3-methylimidazolium bromide salts

D'ANGELO, Paola;ZITOLO, ANDREA;MIGLIORATI, VALENTINA;BODO, Enrico;CAMINITI, Ruggero
2011

Abstract

X-ray absorption spectroscopy (XAS) has been used to unveil the bromide ion local coordination structure in 1-alkyl-3-methylimidazolium bromide [C(n)mim]Br ionic liquids (ILs) with different alkyl chains. The XAS spectrum of 1-ethyl-3-methylimidazolium bromide has been found to be different from those of the other members of the series, from the butyl to the decyl derivatives, that have all identical XAS spectra. This result indicates that starting from 1-buthyl-3-methylimidazolium bromide the local molecular arrangement around the bromide anion is the same independently from the length of the alkyl chain, and that the imidazolium head groups in the liquid ILs with long alkyl chains assume locally the same orientation as in the [C(4)mim]Br crystal. With this study we show that the XAS technique is an effective direct tool for unveiling the local structural arrangements around selected atoms in ILs. (C) 2011 American Institute of Physics. [doi: 10.1063/1.3625920]
2011
alkyl chain length; aqua ion; aqueous solution; body distribution functions; cation; condensed matter; fine structure; hydration; molecular configurations; molecular dynamics simulations; negative ions; organic compounds; temperature ionic liquids; x-ray absorption spectra
01 Pubblicazione su rivista::01a Articolo in rivista
X-Ray absorption spectroscopy investigation of 1-alkyl-3-methylimidazolium bromide salts / D'Angelo, Paola; Zitolo, Andrea; Migliorati, Valentina; Bodo, Enrico; Giuliana, Aquilanti; Louis Hazemann, Jean; Denis, Testemale; Mancini, Giordano; Caminiti, Ruggero. - In: THE JOURNAL OF CHEMICAL PHYSICS. - ISSN 0021-9606. - STAMPA. - 135:7(2011), p. 074505. [10.1063/1.3625920]
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/11573/383588
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