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Spectroscopic investigation of β-cyclodextrin -metoprolol tartrate inclusion complexes
Authors:Felicia Dragan  I Bratu  Gh Borodi  Mihaela Toma  A Hernanz  S Simon  Gh Cristea  R Peschar
Institution:(1) Faculty of Pharmacy, University of Oradea, 1 Armatei Romane st, Oradea, Romania;(2) National R&D Institute of Isotopic and Molecular Technologies, P.O. Box 700, 400293 Cluj-Napoca 5, Romania;(3) Dep. CCTT Físicoquimicas, UNED Madrid, Senda del Rey 9, 28040 Madrid, Spain;(4) Faculty of Physics, ’Babes-Bolyai’ University, 1 Kogalniceanu st, Cluj-Napoca, Romania;(5) Laboratory for Crystallography, Universiteit van Amsterdam, Van ‘t Hoff Institute for Molecular Sciences, Valckenierstraat 65, 1018XE Amsterdam, The Netherlands
Abstract:Aqueous-solution complexes of β-cyclodextrin (β-CD) with metoprolol tartrate (MET) have been analysed with 1H NMR and UV–vis spectroscopy. With 1H NMR a 1:1] stoichiometry could be established for the β-CD-MET complex while its stability constant was determined with UV–vis spectroscopy. Powder diffraction data of a polycrystalline sample of the β-CD-MET complex show that a novel product has been formed, likely to be a β-CD-MET 1:1] inclusion complex. Also Hyperchem MM+ molecular-dynamics results suggest an inclusion complex and from 1H NMR data it is inferred that probably the MET is docked in the CD with the formers methoxyethyl-benzene moiety in front. Mihaela Toma is Socrates/Erasmus student at UNED Madrid
Keywords:Inclusion complexes  Cyclodextrin  Metoprolol  Cardiovascular adrenoreceptor antagonist  Powder diffraction  NMR  UV–  vis  Stoichiometry  Stability constant
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