Matches in SemOpenAlex for { <https://semopenalex.org/work/W2007000760> ?p ?o ?g. }
Showing items 1 to 78 of
78
with 100 items per page.
- W2007000760 endingPage "1365" @default.
- W2007000760 startingPage "1356" @default.
- W2007000760 abstract "Abstract A computational study of the compound containing selenium, 2-selenobarbituric acid, has been carried out. Tautomerism has been studied not only in neutral forms but also in the protonated and deprotonated species. The most stable tautomers for neutral and deprotonated species are equivalent to those obtained by different authors for the analogous barbituric and 2-thiobarbituric acids. However, the most stable tautomer for the protonated 2-selenobarbituric acid differs of that proposed for the analogous compounds. The enthalpy of formation in the gas phase, and the gas-phase acidity and basicity of 2-selenobarbituric acid have been calculated at the G3 and G4 levels, together with the corresponding values for barbituric and 2-thiobarbituric acids. The calculated acidity shows that 2- selenobarbituric acid is a very strong Bronsted acid in the gas phase." @default.
- W2007000760 created "2016-06-24" @default.
- W2007000760 creator A5085256024 @default.
- W2007000760 date "2014-01-01" @default.
- W2007000760 modified "2023-09-26" @default.
- W2007000760 title "A Computational Study of 2-Selenobarbituric Acid: Conformational Analysis, Enthalpy of Formation, Acidity and Basicity" @default.
- W2007000760 cites W1499419532 @default.
- W2007000760 cites W1971955309 @default.
- W2007000760 cites W1976468501 @default.
- W2007000760 cites W1984006149 @default.
- W2007000760 cites W1987302868 @default.
- W2007000760 cites W1990875333 @default.
- W2007000760 cites W1993182587 @default.
- W2007000760 cites W2019476805 @default.
- W2007000760 cites W2031653187 @default.
- W2007000760 cites W2032240090 @default.
- W2007000760 cites W2035110211 @default.
- W2007000760 cites W2040195084 @default.
- W2007000760 cites W2040246654 @default.
- W2007000760 cites W2044039308 @default.
- W2007000760 cites W2045323145 @default.
- W2007000760 cites W2046503396 @default.
- W2007000760 cites W2065673209 @default.
- W2007000760 cites W2066408771 @default.
- W2007000760 cites W2067146230 @default.
- W2007000760 cites W2075711588 @default.
- W2007000760 cites W2081340748 @default.
- W2007000760 cites W2162325501 @default.
- W2007000760 cites W2950181872 @default.
- W2007000760 cites W577077142 @default.
- W2007000760 cites W2465711798 @default.
- W2007000760 cites W2523020761 @default.
- W2007000760 doi "https://doi.org/10.1016/j.procs.2014.05.122" @default.
- W2007000760 hasPublicationYear "2014" @default.
- W2007000760 type Work @default.
- W2007000760 sameAs 2007000760 @default.
- W2007000760 citedByCount "1" @default.
- W2007000760 countsByYear W20070007602020 @default.
- W2007000760 crossrefType "journal-article" @default.
- W2007000760 hasAuthorship W2007000760A5085256024 @default.
- W2007000760 hasBestOaLocation W20070007601 @default.
- W2007000760 hasConcept C121332964 @default.
- W2007000760 hasConcept C147368240 @default.
- W2007000760 hasConcept C147789679 @default.
- W2007000760 hasConcept C185592680 @default.
- W2007000760 hasConcept C3288061 @default.
- W2007000760 hasConcept C41008148 @default.
- W2007000760 hasConcept C59801894 @default.
- W2007000760 hasConcept C97355855 @default.
- W2007000760 hasConceptScore W2007000760C121332964 @default.
- W2007000760 hasConceptScore W2007000760C147368240 @default.
- W2007000760 hasConceptScore W2007000760C147789679 @default.
- W2007000760 hasConceptScore W2007000760C185592680 @default.
- W2007000760 hasConceptScore W2007000760C3288061 @default.
- W2007000760 hasConceptScore W2007000760C41008148 @default.
- W2007000760 hasConceptScore W2007000760C59801894 @default.
- W2007000760 hasConceptScore W2007000760C97355855 @default.
- W2007000760 hasLocation W20070007601 @default.
- W2007000760 hasLocation W20070007602 @default.
- W2007000760 hasOpenAccess W2007000760 @default.
- W2007000760 hasPrimaryLocation W20070007601 @default.
- W2007000760 hasRelatedWork W1519718366 @default.
- W2007000760 hasRelatedWork W1968519025 @default.
- W2007000760 hasRelatedWork W1975004961 @default.
- W2007000760 hasRelatedWork W2028911446 @default.
- W2007000760 hasRelatedWork W2074353606 @default.
- W2007000760 hasRelatedWork W2249466452 @default.
- W2007000760 hasRelatedWork W2326166357 @default.
- W2007000760 hasRelatedWork W2953153862 @default.
- W2007000760 hasRelatedWork W4206711649 @default.
- W2007000760 hasRelatedWork W2184077981 @default.
- W2007000760 hasVolume "29" @default.
- W2007000760 isParatext "false" @default.
- W2007000760 isRetracted "false" @default.
- W2007000760 magId "2007000760" @default.
- W2007000760 workType "article" @default.