Isomer selective IR experiments and correlated ab initio quantum chemical calculations support planar H-bonded structure of the 7-methyl adenine...adenine and stacked structure of the 9-methyl adenine base pairs
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61388963%3A_____%2F04%3A00100870" target="_blank" >RIV/61388963:_____/04:00100870 - 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
Isomer selective IR experiments and correlated ab initio quantum chemical calculations support planar H-bonded structure of the 7-methyl adenine...adenine and stacked structure of the 9-methyl adenine base pairs
Original language description
In this paper we show that the stacked structures of 9-methyl adenine...adenine are comparably stabe as the most stable hydrogen bonded structures and that the calculated IR pattern of the stacked structures is in a very good agreement with the experimental spectrum. The pair 7-methyl adenine...adenine on the other hand shows a nearly planar hydrogen bond arrangement and no stacked structure was observed
Czech name
Isomerově selektivní IČ experimenty potvzují existenci planarní vodíkově vázané struktury páru 7-methyl adenin...adenin a patrové struktury páru 9-methyl adenin...adenin
Czech description
V této práci je ukázáno, že patrové a planární struktury páru bazí 9-methyl adenin...adenin jsou přibližně stejně stabilní a vypočtené IČ spektrum patrové struktury odpovídá experimentálně nalezenému spektru. Naopak v páru 7-methyl adenin...adenin byla nalezena pouze planární struktura
Classification
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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Result continuities
Project
<a href="/en/project/LN00A032" target="_blank" >LN00A032: Structure and dynamics of complex molecular systems and biomolecules</a><br>
Continuities
Z - Vyzkumny zamer (s odkazem do CEZ)
Others
Publication year
2004
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Name of the periodical
Physical Chemistry Chemical Physics
ISSN
1463-9076
e-ISSN
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Volume of the periodical
6
Issue of the periodical within the volume
-
Country of publishing house
GB - UNITED KINGDOM
Number of pages
5
Pages from-to
2781-2785
UT code for WoS article
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EID of the result in the Scopus database
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