Kazan (Volga region) Federal University, KFU
KAZAN
FEDERAL UNIVERSITY
 
SPATIAL STRUCTURE OF FELODIPINE DISSOLVED IN DMSO BY 1D NOE AND 2D NOESY NMR SPECTROSCOPY
Form of presentationArticles in international journals and collections
Year of publication2013
Языканглийский
  • Blokhin Dmitriy Sergeevich, author
  • Klochkov Vladimir Vasilevich, author
  • Khodov Ilya Anatolevich, author
  • Bibliographic description in the original language Khodov I.A, Nikiforov M.Yu, Alper G.A, Spatial structure of felodipine dissolved in DMSO by 1D NOE and 2D NOESY NMR spectroscopy//Journal of Molecular Structure. - 2013. - Vol.1035, Is.. - P.358-362.
    Annotation Small organic molecules in dissolved state exist as an ensemble of conformers. In this work conformation of felodipine in dimethyl sulphoxide was studied and dominant stable conformers were determined. Effective interatomic distances were obtained by means of NOE spectroscopy. Fractions of different conformers were estimated by comparing effective distances and those obtained from quantum-chemical calculation [8]; averaging of distances was made following the N-site jump model. ? 2012 Elsevier B.V. All rights reserved.
    Keywords Conformational analysis, Jump model, NOE, Nuclear magnetic resonance.
    The name of the journal JOURNAL OF MOLECULAR STRUCTURE
    URL https://www.scopus.com/inward/record.uri?eid=2-s2.0-84873579118&partnerID=40&md5=941f992469cbb9d05fd4faeddc03ee58
    Please use this ID to quote from or refer to the card https://repository.kpfu.ru/eng/?p_id=159266&p_lang=2

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