Articles producció científicaQuímica Física i Inorgànica

Asymmetric Choreography in Pairs of Orthogonal Rotors

  • Identification data

    Identifier:  imarina:5132289
    Handle: https://hdl.handle.net/20.500.11797/imarina5132289
    Authors:  Rodriguez-Fortea, Antonio; Kaleta, Jiri; Meziere, Cepcile; Allain, Magali; Canadell, Enric; Wzietek, Pawel; Michl, Josef; Batail, Patrick
    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.

  • Others:

    Link to the original source: https://pubs.acs.org/doi/10.1021/acsomega.7b01580
    APA: Rodriguez-Fortea, Antonio; Kaleta, Jiri; Meziere, Cepcile; Allain, Magali; Canadell, Enric; Wzietek, Pawel; Michl, Josef; Batail, Patrick (2018). Asymmetric Choreography in Pairs of Orthogonal Rotors. Acs Omega, 3(1), 1293-1297. DOI: 10.1021/acsomega.7b01580
    Paper original source: Acs Omega. 3 (1): 1293-1297
    Article's DOI: 10.1021/acsomega.7b01580
    Journal publication year: 2018
    Entity: Universitat Rovira i Virgili
    Paper version: info:eu-repo/semantics/publishedVersion
    Record's date: 2025-02-08
    First page: 1293
    URV's Author/s: Rodríguez Fortea, Antonio
    Department: Química Física i Inorgànica
    Licence document URL: https://repositori.urv.cat/ca/proteccio-de-dades/
    Publication Type: Journal Publications
    Last page: 1297
    ISSN: 24701343
    Author, as appears in the article.: Rodriguez-Fortea, Antonio; Kaleta, Jiri; Meziere, Cepcile; Allain, Magali; Canadell, Enric; Wzietek, Pawel; Michl, Josef; Batail, Patrick
    Journal volume: 3
    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)
    Author's mail: antonio.rodriguezf@urv.cat

  • Keywords:

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

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