Small steric effects in isolated molecules: alkyl-substituted benzonitriles.
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61388963%3A_____%2F02%3A57020091" target="_blank" >RIV/61388963:_____/02:57020091 - 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
Small steric effects in isolated molecules: alkyl-substituted benzonitriles.
Original language description
A series of seven alkyl-substituted benzonitriles was investigated as a model for small steric effects. The energies were calculated at a B3LYP/6-311+G(d.p) level and the gas-phase basicities measured by ion cyclotron resonance. Substituent effects wereevaluated for neutral molecules and protonated forms.
Czech name
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Czech description
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Classification
Type
J<sub>x</sub> - Unclassified - Peer-reviewed scientific article (Jimp, Jsc and Jost)
CEP classification
CC - Organic chemistry
OECD FORD branch
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Result continuities
Project
<a href="/en/project/GA203%2F99%2F1454" target="_blank" >GA203/99/1454: Thermodynamics of substituent effects in water solution</a><br>
Continuities
P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)<br>Z - Vyzkumny zamer (s odkazem do CEZ)
Others
Publication year
2002
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Name of the periodical
Journal of the Chemical Society. Perkin Transactions 2
ISSN
1472-779X
e-ISSN
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Volume of the periodical
N/A
Issue of the periodical within the volume
2
Country of publishing house
GB - UNITED KINGDOM
Number of pages
5
Pages from-to
168-172
UT code for WoS article
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EID of the result in the Scopus database
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