Cargando…

Ultrafast Independent N−H and N−C Bond Deformation Investigated with Resonant Inelastic X‐Ray Scattering

The femtosecond excited‐state dynamics following resonant photoexcitation enable the selective deformation of N−H and N−C chemical bonds in 2‐thiopyridone in aqueous solution with optical or X‐ray pulses. In combination with multiconfigurational quantum‐chemical calculations, the orbital‐specific el...

Descripción completa

Detalles Bibliográficos
Autores principales: Eckert, Sebastian, Norell, Jesper, Miedema, Piter S., Beye, Martin, Fondell, Mattis, Quevedo, Wilson, Kennedy, Brian, Hantschmann, Markus, Pietzsch, Annette, Van Kuiken, Benjamin E., Ross, Matthew, Minitti, Michael P., Moeller, Stefan P., Schlotter, William F., Khalil, Munira, Odelius, Michael, Föhlisch, Alexander
Formato: Online Artículo Texto
Lenguaje:English
Publicado: John Wiley and Sons Inc. 2017
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5485001/
https://www.ncbi.nlm.nih.gov/pubmed/28374523
http://dx.doi.org/10.1002/anie.201700239
_version_ 1783245983667191808
author Eckert, Sebastian
Norell, Jesper
Miedema, Piter S.
Beye, Martin
Fondell, Mattis
Quevedo, Wilson
Kennedy, Brian
Hantschmann, Markus
Pietzsch, Annette
Van Kuiken, Benjamin E.
Ross, Matthew
Minitti, Michael P.
Moeller, Stefan P.
Schlotter, William F.
Khalil, Munira
Odelius, Michael
Föhlisch, Alexander
author_facet Eckert, Sebastian
Norell, Jesper
Miedema, Piter S.
Beye, Martin
Fondell, Mattis
Quevedo, Wilson
Kennedy, Brian
Hantschmann, Markus
Pietzsch, Annette
Van Kuiken, Benjamin E.
Ross, Matthew
Minitti, Michael P.
Moeller, Stefan P.
Schlotter, William F.
Khalil, Munira
Odelius, Michael
Föhlisch, Alexander
author_sort Eckert, Sebastian
collection PubMed
description The femtosecond excited‐state dynamics following resonant photoexcitation enable the selective deformation of N−H and N−C chemical bonds in 2‐thiopyridone in aqueous solution with optical or X‐ray pulses. In combination with multiconfigurational quantum‐chemical calculations, the orbital‐specific electronic structure and its ultrafast dynamics accessed with resonant inelastic X‐ray scattering at the N 1s level using synchrotron radiation and the soft X‐ray free‐electron laser LCLS provide direct evidence for this controlled photoinduced molecular deformation and its ultrashort timescale.
format Online
Article
Text
id pubmed-5485001
institution National Center for Biotechnology Information
language English
publishDate 2017
publisher John Wiley and Sons Inc.
record_format MEDLINE/PubMed
spelling pubmed-54850012017-07-11 Ultrafast Independent N−H and N−C Bond Deformation Investigated with Resonant Inelastic X‐Ray Scattering Eckert, Sebastian Norell, Jesper Miedema, Piter S. Beye, Martin Fondell, Mattis Quevedo, Wilson Kennedy, Brian Hantschmann, Markus Pietzsch, Annette Van Kuiken, Benjamin E. Ross, Matthew Minitti, Michael P. Moeller, Stefan P. Schlotter, William F. Khalil, Munira Odelius, Michael Föhlisch, Alexander Angew Chem Int Ed Engl Communications The femtosecond excited‐state dynamics following resonant photoexcitation enable the selective deformation of N−H and N−C chemical bonds in 2‐thiopyridone in aqueous solution with optical or X‐ray pulses. In combination with multiconfigurational quantum‐chemical calculations, the orbital‐specific electronic structure and its ultrafast dynamics accessed with resonant inelastic X‐ray scattering at the N 1s level using synchrotron radiation and the soft X‐ray free‐electron laser LCLS provide direct evidence for this controlled photoinduced molecular deformation and its ultrashort timescale. John Wiley and Sons Inc. 2017-04-04 2017-05-22 /pmc/articles/PMC5485001/ /pubmed/28374523 http://dx.doi.org/10.1002/anie.201700239 Text en © 2017 The Authors. Published by Wiley-VCH Verlag GmbH & Co. KGaA. This is an open access article under the terms of the Creative Commons Attribution‐NonCommercial‐NoDerivs (http://creativecommons.org/licenses/by-nc-nd/4.0/) License, which permits use and distribution in any medium, provided the original work is properly cited, the use is non‐commercial and no modifications or adaptations are made.
spellingShingle Communications
Eckert, Sebastian
Norell, Jesper
Miedema, Piter S.
Beye, Martin
Fondell, Mattis
Quevedo, Wilson
Kennedy, Brian
Hantschmann, Markus
Pietzsch, Annette
Van Kuiken, Benjamin E.
Ross, Matthew
Minitti, Michael P.
Moeller, Stefan P.
Schlotter, William F.
Khalil, Munira
Odelius, Michael
Föhlisch, Alexander
Ultrafast Independent N−H and N−C Bond Deformation Investigated with Resonant Inelastic X‐Ray Scattering
title Ultrafast Independent N−H and N−C Bond Deformation Investigated with Resonant Inelastic X‐Ray Scattering
title_full Ultrafast Independent N−H and N−C Bond Deformation Investigated with Resonant Inelastic X‐Ray Scattering
title_fullStr Ultrafast Independent N−H and N−C Bond Deformation Investigated with Resonant Inelastic X‐Ray Scattering
title_full_unstemmed Ultrafast Independent N−H and N−C Bond Deformation Investigated with Resonant Inelastic X‐Ray Scattering
title_short Ultrafast Independent N−H and N−C Bond Deformation Investigated with Resonant Inelastic X‐Ray Scattering
title_sort ultrafast independent n−h and n−c bond deformation investigated with resonant inelastic x‐ray scattering
topic Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5485001/
https://www.ncbi.nlm.nih.gov/pubmed/28374523
http://dx.doi.org/10.1002/anie.201700239
work_keys_str_mv AT eckertsebastian ultrafastindependentnhandncbonddeformationinvestigatedwithresonantinelasticxrayscattering
AT norelljesper ultrafastindependentnhandncbonddeformationinvestigatedwithresonantinelasticxrayscattering
AT miedemapiters ultrafastindependentnhandncbonddeformationinvestigatedwithresonantinelasticxrayscattering
AT beyemartin ultrafastindependentnhandncbonddeformationinvestigatedwithresonantinelasticxrayscattering
AT fondellmattis ultrafastindependentnhandncbonddeformationinvestigatedwithresonantinelasticxrayscattering
AT quevedowilson ultrafastindependentnhandncbonddeformationinvestigatedwithresonantinelasticxrayscattering
AT kennedybrian ultrafastindependentnhandncbonddeformationinvestigatedwithresonantinelasticxrayscattering
AT hantschmannmarkus ultrafastindependentnhandncbonddeformationinvestigatedwithresonantinelasticxrayscattering
AT pietzschannette ultrafastindependentnhandncbonddeformationinvestigatedwithresonantinelasticxrayscattering
AT vankuikenbenjamine ultrafastindependentnhandncbonddeformationinvestigatedwithresonantinelasticxrayscattering
AT rossmatthew ultrafastindependentnhandncbonddeformationinvestigatedwithresonantinelasticxrayscattering
AT minittimichaelp ultrafastindependentnhandncbonddeformationinvestigatedwithresonantinelasticxrayscattering
AT moellerstefanp ultrafastindependentnhandncbonddeformationinvestigatedwithresonantinelasticxrayscattering
AT schlotterwilliamf ultrafastindependentnhandncbonddeformationinvestigatedwithresonantinelasticxrayscattering
AT khalilmunira ultrafastindependentnhandncbonddeformationinvestigatedwithresonantinelasticxrayscattering
AT odeliusmichael ultrafastindependentnhandncbonddeformationinvestigatedwithresonantinelasticxrayscattering
AT fohlischalexander ultrafastindependentnhandncbonddeformationinvestigatedwithresonantinelasticxrayscattering