The Mid-IR spectra of 9-ethyl guanine, guanosine, and 2-deoxyguanosine

Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61388963%3A_____%2F07%3A00086039" target="_blank" >RIV/61388963:_____/07:00086039 - isvavai.cz</a>
Result on the web
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DOI - Digital Object Identifier
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Result language
angličtina
Original language name
The Mid-IR spectra of 9-ethyl guanine, guanosine, and 2-deoxyguanosine
Original language description
We present the mid-IR (400-1800 cm-1) spectra of 9-ethyl guanine, guanosine, and 2-deoxyguanosine measured by IR-UV double-resonance spectroscopy. We compare the recorded mid-IR spectra with the spectra of the most stable structures obtained from RI-MP2and RI-DFT-D calculations. The results confirm the enol form for all structures and demonstrate the efficacy of a new approach to DFT calculations that includes dispersion interactions.
Czech name
IČ spektra 9-ethyl guanimu, guanosinu, 2-deoxyguanosinu
Czech description
V práci jsou publikována experimentální a teoreticky spočtená spektra 9-ethyl guaninu, guanosinu a 2-deoxyguanosinu. V práci je demonstrována úspěšnost predikce spekter metodou RI-DFT-D.

Type
J<sub>x</sub> - Unclassified - Peer-reviewed scientific article (Jimp, Jsc and Jost)
CEP classification
CF - Physical chemistry and theoretical chemistry
OECD FORD branch
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Project
Result was created during the realization of more than one project. More information in the Projects tab.
Continuities
Z - Vyzkumny zamer (s odkazem do CEZ)

Publication year
2007
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

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