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Characteristic spin - orbit induced 1H(CH2) chemical shifts upon deprotonation of group 9 polyamine aqua and alcohol complexes
- 1.0329859 - ÚOCHB 2010 RIV US eng J - Journal Article
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. E-ISSN 1520-5126
R&D Projects: GA ČR GA203/09/2037; GA ČR GA202/07/0732; GA AV ČR IAA400550701; GA AV ČR IAA400550705
Institutional research plan: CEZ:AV0Z40550506
Keywords : relativistic effects * 1H NMR * theoretical calculations
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 8.580, year: 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.
Permanent Link: http://hdl.handle.net/11104/0175776
Number of the records: 1