Articles producció científica> Química Física i Inorgànica

Asymmetric Choreography in Pairs of Orthogonal Rotors

  • Dades identificatives

    Identificador: imarina:5132289
    Handle: https://hdl.handle.net/20.500.11797/imarina5132289
    Autors:
    Rodríguez-Fortea A., Kaleta J., Meziere C., Allain M., Canadell E., Wzietek P., Michl J., Batail P.
    Resum:
    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.

  • Altres:

    Autor segons l'article: Rodríguez-Fortea A., Kaleta J., Meziere C., Allain M., Canadell E., Wzietek P., Michl J., Batail P.
    Departament: Química Física i Inorgànica
    Autor/s de la URV: Rodríguez Fortea, Antonio
    Paraules clau: Spin-lattice relaxation Rotors Rotation barriers
    Resum: 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.
    Àrees temàtiques: 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
    Adreça de correu electrònic de l'autor: antonio.rodriguezf@urv.cat
    Identificador de l'autor: 0000-0001-5884-5629
    Pàgina final: 1297
    Data d'alta del registre: 2024-09-07
    Volum de revista: 3
    Versió de l'article dipositat: info:eu-repo/semantics/publishedVersion
    Enllaç font original: https://pubs.acs.org/doi/10.1021/acsomega.7b01580
    URL Document de llicència: https://repositori.urv.cat/ca/proteccio-de-dades/
    Referència a l'article segons font original: Acs Omega. 3 (1): 1293-1297
    Referència de l'ítem segons les normes 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
    DOI de l'article: 10.1021/acsomega.7b01580
    Entitat: Universitat Rovira i Virgili
    Any de publicació de la revista: 2018
    Pàgina inicial: 1293
    Tipus de publicació: Journal Publications

  • Paraules clau:

    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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