Matrix-isolation FTIR study of azidoacetone and azidoacetonitrile

Azidoacetonitrile (N₃CH₂CN) and azidoacetone (N₃CH₂COCH₃) were studied by matrix-isolation FTIR spectroscopy in solid neon, argon and nitrogen. The IR spectra calculated using the density fuctional theoretical method are discussed in comparison with the experimental data. Significant broadening of t...

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Veröffentlicht in:Физика низких температур
Datum:2003
Hauptverfasser: Frankowski, Marcin, Algarra, Manuel, Rodrigues, Paula, Barros, Maria T., D.S. Cordeiro, M. Natália, Fox, Brigitte S., Smith-Gicklhorn, Alice M., Beyer, Martin K., Costa, Maria L., Bondybey, Vladimir E.
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Sprache:English
Veröffentlicht: Фізико-технічний інститут низьких температур ім. Б.І. Вєркіна НАН України 2003
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Online Zugang:https://nasplib.isofts.kiev.ua/handle/123456789/128943
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Назва журналу:Digital Library of Periodicals of National Academy of Sciences of Ukraine
Zitieren:Matrix-isolation FTIR study of azidoacetone and azidoacetonitrile / Marcin Frankowski, Manuel Algarra, Paula Rodrigues, Maria T. Barros, M. Natália D.S. Cordeiro, Brigitte S. Fox, Alice M. Smith-Gicklhorn, Martin K. Beyer, Maria L. Costa, Vladimir E. Bondybey // Физика низких температур. — 2003. — Т. 29, № 9-10. — С. 1140-1146. — Бібліогр.: 14 назв. — англ.

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Digital Library of Periodicals of National Academy of Sciences of Ukraine
id nasplib_isofts_kiev_ua-123456789-128943
record_format dspace
spelling Frankowski, Marcin
Algarra, Manuel
Rodrigues, Paula
Barros, Maria T.
D.S. Cordeiro, M. Natália
Fox, Brigitte S.
Smith-Gicklhorn, Alice M.
Beyer, Martin K.
Costa, Maria L.
Bondybey, Vladimir E.
2018-01-14T13:23:19Z
2018-01-14T13:23:19Z
2003
Matrix-isolation FTIR study of azidoacetone and azidoacetonitrile / Marcin Frankowski, Manuel Algarra, Paula Rodrigues, Maria T. Barros, M. Natália D.S. Cordeiro, Brigitte S. Fox, Alice M. Smith-Gicklhorn, Martin K. Beyer, Maria L. Costa, Vladimir E. Bondybey // Физика низких температур. — 2003. — Т. 29, № 9-10. — С. 1140-1146. — Бібліогр.: 14 назв. — англ.
0132-6414
PACS: 67.40.Yv, 07.60.Vg
https://nasplib.isofts.kiev.ua/handle/123456789/128943
Azidoacetonitrile (N₃CH₂CN) and azidoacetone (N₃CH₂COCH₃) were studied by matrix-isolation FTIR spectroscopy in solid neon, argon and nitrogen. The IR spectra calculated using the density fuctional theoretical method are discussed in comparison with the experimental data. Significant broadening of the recorded azide bands indicate an awkward fit of these compounds into the solid environment. The strongest absorption is observed for both compounds in the regions of asymmetric and symmetric stretches of the N₃ azide group. Strong band splittings in the N₃ asymmetric stretch region can be most likely explained by very strong Fermi resonances with the CN stretch and combinations and overtones of the numerous lower frequency vibrational modes.
Authors gratefully acknowledge the EU for financial support within the Research Training Network «Reactive Intermediates».
en
Фізико-технічний інститут низьких температур ім. Б.І. Вєркіна НАН України
Физика низких температур
Spectroscopy in Cryocrystals and Matrices
Matrix-isolation FTIR study of azidoacetone and azidoacetonitrile
Article
published earlier
institution Digital Library of Periodicals of National Academy of Sciences of Ukraine
collection DSpace DC
title Matrix-isolation FTIR study of azidoacetone and azidoacetonitrile
spellingShingle Matrix-isolation FTIR study of azidoacetone and azidoacetonitrile
Frankowski, Marcin
Algarra, Manuel
Rodrigues, Paula
Barros, Maria T.
D.S. Cordeiro, M. Natália
Fox, Brigitte S.
Smith-Gicklhorn, Alice M.
Beyer, Martin K.
Costa, Maria L.
Bondybey, Vladimir E.
Spectroscopy in Cryocrystals and Matrices
title_short Matrix-isolation FTIR study of azidoacetone and azidoacetonitrile
title_full Matrix-isolation FTIR study of azidoacetone and azidoacetonitrile
title_fullStr Matrix-isolation FTIR study of azidoacetone and azidoacetonitrile
title_full_unstemmed Matrix-isolation FTIR study of azidoacetone and azidoacetonitrile
title_sort matrix-isolation ftir study of azidoacetone and azidoacetonitrile
author Frankowski, Marcin
Algarra, Manuel
Rodrigues, Paula
Barros, Maria T.
D.S. Cordeiro, M. Natália
Fox, Brigitte S.
Smith-Gicklhorn, Alice M.
Beyer, Martin K.
Costa, Maria L.
Bondybey, Vladimir E.
author_facet Frankowski, Marcin
Algarra, Manuel
Rodrigues, Paula
Barros, Maria T.
D.S. Cordeiro, M. Natália
Fox, Brigitte S.
Smith-Gicklhorn, Alice M.
Beyer, Martin K.
Costa, Maria L.
Bondybey, Vladimir E.
topic Spectroscopy in Cryocrystals and Matrices
topic_facet Spectroscopy in Cryocrystals and Matrices
publishDate 2003
language English
container_title Физика низких температур
publisher Фізико-технічний інститут низьких температур ім. Б.І. Вєркіна НАН України
format Article
description Azidoacetonitrile (N₃CH₂CN) and azidoacetone (N₃CH₂COCH₃) were studied by matrix-isolation FTIR spectroscopy in solid neon, argon and nitrogen. The IR spectra calculated using the density fuctional theoretical method are discussed in comparison with the experimental data. Significant broadening of the recorded azide bands indicate an awkward fit of these compounds into the solid environment. The strongest absorption is observed for both compounds in the regions of asymmetric and symmetric stretches of the N₃ azide group. Strong band splittings in the N₃ asymmetric stretch region can be most likely explained by very strong Fermi resonances with the CN stretch and combinations and overtones of the numerous lower frequency vibrational modes.
issn 0132-6414
url https://nasplib.isofts.kiev.ua/handle/123456789/128943
citation_txt Matrix-isolation FTIR study of azidoacetone and azidoacetonitrile / Marcin Frankowski, Manuel Algarra, Paula Rodrigues, Maria T. Barros, M. Natália D.S. Cordeiro, Brigitte S. Fox, Alice M. Smith-Gicklhorn, Martin K. Beyer, Maria L. Costa, Vladimir E. Bondybey // Физика низких температур. — 2003. — Т. 29, № 9-10. — С. 1140-1146. — Бібліогр.: 14 назв. — англ.
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