Intermolecular Hydrogen Bonding and Molecular Orbital Distortion in 4-Hydroxycyanobenzene Investigated by X-Ray Spectroscopy (Articolo in rivista)

Type

• Articolo in rivista (Classe)
• Prodotto della ricerca (Classe)

Label

• Intermolecular Hydrogen Bonding and Molecular Orbital Distortion in 4-Hydroxycyanobenzene Investigated by X-Ray Spectroscopy (Articolo in rivista) (literal)

Anno

• 2015-01-01T00:00:00+01:00 (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#doi

• 10.1021/jp5100878 (literal)

Alternative label

• Giorgia Olivieri\1,2, Albano Cossaro\1, Ennio Capria\3, Luca Benevoli\3, Marcello Coreno\4, Monica de Simone\1,Kevin C. Prince\3,5, Gregor Kladnik\6, Dean Cvetko\6, Beatrice Fraboni\7, Alberto Morgante\1,2, Luca Floreano\1, Alessandro Fraleoni Morgera\3,8 (2015)
  Intermolecular Hydrogen Bonding and Molecular Orbital Distortion in 4-Hydroxycyanobenzene Investigated by X-Ray Spectroscopy
  in Journal of physical chemistry. C; American Chemical Society, Washington (Stati Uniti d'America)
  (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#autori

• Giorgia Olivieri,2, Albano Cossaro, Ennio Capria, Luca Benevoli, Marcello Coreno, Monica de Simone,Kevin C. Prince,5, Gregor Kladnik, Dean Cvetko, Beatrice Fraboni, Alberto Morgante,2, Luca Floreano, Alessandro Fraleoni Morgera,8 (literal)

Pagina inizio

• 121 (literal)

Pagina fine

• 129 (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#url

• http://pubs.acs.org/doi/abs/10.1021/jp5100878 (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#numeroVolume

• 119 (literal)

Rivista

• Journal of physical chemistry. C (Rivista)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#pagineTotali

• 9 (literal)

Note

• Scopu (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#affiliazioni

• 1- CNR - Istituto Officina dei Materiali, TASC Laboratory, S.S. 14, km 163.5, 34149 Basovizza (TS), Italy 2- Department of Physics, University of Trieste, I-34123 Trieste, Italy 3- Elettra - Sincrotrone Trieste SCpA, S.S. 14, km 163.5, 34149 Basovizza (TS), Italy 4- CNR - Istituto di Struttura della Materia, Trieste, Basovizza Area Science Park, 34149 Trieste, Italy 5- Chemistry Laboratory, Faculty of Life and Social Sciences, Swinburne University of Technology, Melbourne, Victoria 3122, Australia 6- Department of Physics, Faculty of Mathematics and Physics, University of Ljubljana, Ljubljana, Slovenia 7- Department of Physics, University of Bologna, viale Berti Pichat 6/2, 40127 Bologna, Italy 8- Dept. of Engineering and Architecture, University of Trieste, v. Valerio 10, 34100 Trieste, Italy (literal)

Titolo

• Intermolecular Hydrogen Bonding and Molecular Orbital Distortion in 4-Hydroxycyanobenzene Investigated by X-Ray Spectroscopy (literal)

Abstract

• Electronic structure of 4-hydroxycyanobenzene in the gas phase, thick films, and single crystals has been investigated by X-ray photoemission spectroscopy (XPS) and near edge X-ray absorption fine structure spectroscopy (NEXAFS). We have used resonant photoemission spectroscopy (RESPES) to identify the symmetry and atomic localization of the occupied and unoccupied molecular orbitals for the free molecule. Upon condensation into a thick film, we find XPS energy shifts in opposite directions for the oxygen and nitrogen core levels, consistent with the formation of an intermolecular hydrogen bond. This interaction is also accompanied by a significant spatial distortion of the lowest unoccupied molecular orbital that is displaced from the nitrogen atom, as indicated by the RESPES measurements. Thick films and single crystals display the same dichroism in polarization dependent NEXAFS, indicating that the intermolecular hydrogen bonding also steers the molecular assembly into a preferred molecular orientation. (literal)

Editore

• American Chemical Society (Editore)

Prodotto di

• MD.P06.016.001 Proprieta' elettroniche e strutturali di sistemi a bassa dimensionalita' (MD.P06.016.003) (Modulo)
• MD.P06.016.002 Sistemi a bassa densita' e nanostrutture in fase gassosa (MD.P06.016.004) (Modulo)
• Institute of structure of matter (ISM) (Istituto)

Autore CNR

• GIORGIA OLIVIERI (Persona)
• ALBERTO MORGANTE (Unità di personale interno)
• MARCELLO CORENO (Unità di personale interno)
• MONICA DE SIMONE (Persona)
• LUCA FLOREANO (Persona)
• ALBANO COSSARO (Persona)

Incoming links:

Autore CNR di

• ALBANO COSSARO (Persona)
• LUCA FLOREANO (Persona)
• MARCELLO CORENO (Unità di personale interno)
• MONICA DE SIMONE (Persona)
• GIORGIA OLIVIERI (Persona)
• ALBERTO MORGANTE (Unità di personale interno)

Prodotto

• Institute of structure of matter (ISM) (Istituto)
• MD.P06.016.001 Proprieta' elettroniche e strutturali di sistemi a bassa dimensionalita' (MD.P06.016.003) (Modulo)
• MD.P06.016.002 Sistemi a bassa densita' e nanostrutture in fase gassosa (MD.P06.016.004) (Modulo)

Editore di

• American Chemical Society (Editore)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#rivistaDi

• Journal of physical chemistry. C (Rivista)