On the solid-state NMR spectra of naproxen

Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61389013%3A_____%2F15%3A00439621" target="_blank" >RIV/61389013:_____/15:00439621 - isvavai.cz</a>
Result on the web
<a href="http://dx.doi.org/10.1016/j.cplett.2014.11.031" target="_blank" >http://dx.doi.org/10.1016/j.cplett.2014.11.031</a>
DOI - Digital Object Identifier
<a href="http://dx.doi.org/10.1016/j.cplett.2014.11.031" target="_blank" >10.1016/j.cplett.2014.11.031</a>

Result language
angličtina
Original language name
On the solid-state NMR spectra of naproxen
Original language description
Two previous measurements of the 13C and 1H NMR isotropic chemical shifts in crystalline naproxen, which is an important pharmaceutical compound, are confronted with the results obtained from several theoretical approaches capable of the proper treatmentof solid-phase effects. In the underlying geometrical optimizations, two crystal structures are considered. The agreement between the data sets is quantified, including an evaluation of the similarity between the experimental solid-state NMR spectra. The 13C?1H heteronuclear correlations are analyzed, and their various assignments are discussed employing the statistical treatment of the differences between the measured and theoretical isotropic chemical shifts.
Czech name
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Czech description
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Type
J<sub>x</sub> - Unclassified - Peer-reviewed scientific article (Jimp, Jsc and Jost)
CEP classification
CD - Macromolecular chemistry
OECD FORD branch
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Project
<a href="/en/project/GA14-03636S" target="_blank" >GA14-03636S: Preparation and characterization of advanced multicomponent pharmaceutical solids with targeted physicochemical properties</a><br>
Continuities
I - Institucionalni podpora na dlouhodoby koncepcni rozvoj vyzkumne organizace

Publication year
2015
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

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