Articles producció científica> Química Física i Inorgànica

Asymmetric Choreography in Pairs of Orthogonal Rotors

  • Identification data

    Identifier: imarina:5132289
    Handle: http://hdl.handle.net/20.500.11797/imarina5132289
  • Authors:

    Rodríguez-Fortea A., Kaleta J., Meziere C., Allain M., Canadell E., Wzietek P., Michl J., Batail P.
  • Others:

    Author, as appears in the article.: Rodríguez-Fortea A., Kaleta J., Meziere C., Allain M., Canadell E., Wzietek P., Michl J., Batail P.
    Department: Química Física i Inorgànica
    URV's Author/s: Rodríguez Fortea, Antonio
    Keywords: Spin-lattice relaxation Rotors Rotation barriers
    Abstract: An asymmetric mechanism for correlated motion occurring in noninteracting pairs of adjacent orthogonal 1,4-bis(carboxyethynyl)bicyclo[1.1.1]pentane (BCP) rotators 1 in the solid state is unraveled and shown to play an important role in understanding the dynamics in the crystalline rotor, Bu4N+[1-]·H2O. Single crystal X-ray diffraction and calculation of rotor-rotor interaction energies combined with variable-temperature, variable-field 1H spin-lattice relaxation experiments led to the identification and microscopic rationalization of two distinct relaxation processes.
    Thematic Areas: Química Interdisciplinar General chemistry General chemical engineering Engenharias ii Ciências agrárias i Chemistry, multidisciplinary Chemistry (miscellaneous) Chemistry (all) Chemical engineering (miscellaneous) Chemical engineering (all)
    ISSN: 24701343
    Author's mail: antonio.rodriguezf@urv.cat
    Author identifier: 0000-0001-5884-5629
    Last page: 1297
    Record's date: 2023-02-18
    Journal volume: 3
    Papper version: info:eu-repo/semantics/publishedVersion
    Link to the original source: https://pubs.acs.org/doi/10.1021/acsomega.7b01580
    Licence document URL: http://repositori.urv.cat/ca/proteccio-de-dades/
    Papper original source: Acs Omega. 3 (1): 1293-1297
    APA: Rodríguez-Fortea A., Kaleta J., Meziere C., Allain M., Canadell E., Wzietek P., Michl J., Batail P. (2018). Asymmetric Choreography in Pairs of Orthogonal Rotors. Acs Omega, 3(1), 1293-1297. DOI: 10.1021/acsomega.7b01580
    Article's DOI: 10.1021/acsomega.7b01580
    Entity: Universitat Rovira i Virgili
    Journal publication year: 2018
    First page: 1293
    Publication Type: Journal Publications
  • Keywords:

    Chemical Engineering (Miscellaneous),Chemistry (Miscellaneous),Chemistry, Multidisciplinary
    Spin-lattice relaxation
    Rotors
    Rotation barriers
    Química
    Interdisciplinar
    General chemistry
    General chemical engineering
    Engenharias ii
    Ciências agrárias i
    Chemistry, multidisciplinary
    Chemistry (miscellaneous)
    Chemistry (all)
    Chemical engineering (miscellaneous)
    Chemical engineering (all)
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