Protonation, tautomerism and hydrogen bonding of purine analogues
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F00216224%3A14310%2F03%3A00008907" target="_blank" >RIV/00216224:14310/03:00008907 - isvavai.cz</a>
Result on the web
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DOI - Digital Object Identifier
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Alternative languages
Result language
angličtina
Original language name
Protonation, tautomerism and hydrogen bonding of purine analogues
Original language description
The variously substituted purine derivatives were investigated by using inverse-detected 15N NMR spectroscopy in the solution at a range of temperatures. Slow-spinning 15N CP/MAS data of selected compounds were recorded in order to study intermolecular interactions in the solid-state and principal values of the 15N chemical shift tensors. DFT calculations of nitrogen chemical shifts were used for determining the solvation effects in the solution and bonding patterns in the solid state, assigning the nitrogen resonances observed in the solid-state spectra, and determining the orientation of the principal components of the chemical shift tensors. Structural arrangements have been correlated with the geometry obtained from single-crystal X-ray diffractionanalysis. Benefits of studying the structure by all these approaches will be discussed.
Czech name
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Czech description
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Classification
Type
D - Article in proceedings
CEP classification
CB - Analytical chemistry, separation
OECD FORD branch
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Result continuities
Project
<a href="/en/project/LN00A016" target="_blank" >LN00A016: BIOMOLECULAR CENTER</a><br>
Continuities
P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)
Others
Publication year
2003
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Article name in the collection
SMASH 2003
ISBN
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ISSN
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e-ISSN
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Number of pages
1
Pages from-to
"SE3"
Publisher name
SMASH 2003 NMR
Place of publication
Verona
Event location
Verona
Event date
Sep 14, 2003
Type of event by nationality
WRD - Celosvětová akce
UT code for WoS article
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