Počet záznamů: 1

Characteristic spin - orbit induced 1H(CH2) chemical shifts upon deprotonation of group 9 polyamine aqua and alcohol complexes

  1. 1.
    0329859 - UOCHB-X 2010 RIV US eng J - Článek v odborném periodiku
    Hyvärinen, M. - Vaara, J. - Goldammer, A. - Kutzky, B. - Hegetschweiler, K. - Kaupp, M. - Straka, Michal
    Characteristic spin - orbit induced 1H(CH2) chemical shifts upon deprotonation of group 9 polyamine aqua and alcohol complexes.
    Journal of the American Chemical Society. Roč. 131, č. 33 (2009), s. 11909-11918 ISSN 0002-7863
    Grant CEP: GA ČR GA203/09/2037; GA ČR GA202/07/0732; GA AV ČR IAA400550701; GA AV ČR IAA400550705
    Výzkumný záměr: CEZ:AV0Z40550506
    Klíčová slova: relativistic effects * 1H NMR * theoretical calculations
    Kód oboru RIV: CF - Fyzikální chemie a teoretická chemie
    Impakt faktor: 8.580, rok: 2009

    Combined computational and experimental study of polyamine polyalcohol complexes of group 9 metals shows unprecedented experimental trends in deprotonation 1H NMR chemical shifts. The trends are explained computationally by remarkably large spin-orbit effects on 1H NMR chemical shifts.
    Trvalý link: http://hdl.handle.net/11104/0175776