Matches in SemOpenAlex for { <https://semopenalex.org/work/W3026766095> ?p ?o ?g. }
Showing items 1 to 61 of
61
with 100 items per page.
- W3026766095 abstract "Environmental water pollution by organic compound has become a major worldwide concern. Aromatic molecules like benzene rings and their derivatives have gained considerable attention due to officially documented toxicity and carcinogenicity. Mostly used in supramolecular chemistry, Cyclodextrins are truncated cone-shaped molecular structures having a hydrophilic outer surface and a hydrophobic cavity. Thus, they can theoretically encapsulate a large number of hydrophobic organic molecules to form water-soluble inclusion complexes. This complexation property has potential application in the field of detection and quantification of aromatic polycyclic pollutants in environmental water by portable spectroscopic means. We are interested in understanding this phenomenon of inclusion by combining theoretical and experimental approaches applied to solid state and in solution. It has been observed that only a few crystalline structures of cyclodextrin- pure aromatic molecule complexes appear in the structural databases after a brief review. Therefore, the main objective of our research is to focus more precisely on the interactions between the aliphatic alcohols and cyclodextrin molecules. For this purpose, to correlate our experimental and theoretical studies, the results obtained were monitored by various spectroscopic techniques in a systematic manner to observe the interaction between the molecules. Moreover, the powders and crystals obtained by varying the solubility of the mixtures were further subjected to physico-chemical analysis, X-ray diffraction, and DSC monitoring to support our findings. This work also includes modeling of inclusion complexes using different approaches like combining semi-empirical methods of quantum chemistry (DFT / TD-DFT) and polarizable molecular mechanics. Calculations were carried out on homemade clusters, which will allow the implementation of evidence of structural and energetic factors for complexation." @default.
- W3026766095 created "2020-05-29" @default.
- W3026766095 creator A5019620627 @default.
- W3026766095 date "2018-11-26" @default.
- W3026766095 modified "2023-09-25" @default.
- W3026766095 title "Investigation of encapsulation of Aromatic polluants by β-Cyclodextrin in presence of linear aliphatic alcohols" @default.
- W3026766095 hasPublicationYear "2018" @default.
- W3026766095 type Work @default.
- W3026766095 sameAs 3026766095 @default.
- W3026766095 citedByCount "0" @default.
- W3026766095 crossrefType "dissertation" @default.
- W3026766095 hasAuthorship W3026766095A5019620627 @default.
- W3026766095 hasConcept C147597530 @default.
- W3026766095 hasConcept C155574463 @default.
- W3026766095 hasConcept C178790620 @default.
- W3026766095 hasConcept C185592680 @default.
- W3026766095 hasConcept C2777691172 @default.
- W3026766095 hasConcept C2779433975 @default.
- W3026766095 hasConcept C2909468537 @default.
- W3026766095 hasConcept C32909587 @default.
- W3026766095 hasConcept C39432304 @default.
- W3026766095 hasConcept C526734887 @default.
- W3026766095 hasConcept C93275456 @default.
- W3026766095 hasConceptScore W3026766095C147597530 @default.
- W3026766095 hasConceptScore W3026766095C155574463 @default.
- W3026766095 hasConceptScore W3026766095C178790620 @default.
- W3026766095 hasConceptScore W3026766095C185592680 @default.
- W3026766095 hasConceptScore W3026766095C2777691172 @default.
- W3026766095 hasConceptScore W3026766095C2779433975 @default.
- W3026766095 hasConceptScore W3026766095C2909468537 @default.
- W3026766095 hasConceptScore W3026766095C32909587 @default.
- W3026766095 hasConceptScore W3026766095C39432304 @default.
- W3026766095 hasConceptScore W3026766095C526734887 @default.
- W3026766095 hasConceptScore W3026766095C93275456 @default.
- W3026766095 hasLocation W30267660951 @default.
- W3026766095 hasOpenAccess W3026766095 @default.
- W3026766095 hasPrimaryLocation W30267660951 @default.
- W3026766095 hasRelatedWork W1796180830 @default.
- W3026766095 hasRelatedWork W1950492405 @default.
- W3026766095 hasRelatedWork W1964208339 @default.
- W3026766095 hasRelatedWork W1965978577 @default.
- W3026766095 hasRelatedWork W1968139300 @default.
- W3026766095 hasRelatedWork W1995367211 @default.
- W3026766095 hasRelatedWork W2007750015 @default.
- W3026766095 hasRelatedWork W2012968950 @default.
- W3026766095 hasRelatedWork W2045280596 @default.
- W3026766095 hasRelatedWork W2052657513 @default.
- W3026766095 hasRelatedWork W2064215432 @default.
- W3026766095 hasRelatedWork W2151097679 @default.
- W3026766095 hasRelatedWork W2436162496 @default.
- W3026766095 hasRelatedWork W2949445082 @default.
- W3026766095 hasRelatedWork W3041209417 @default.
- W3026766095 hasRelatedWork W3202312543 @default.
- W3026766095 hasRelatedWork W1966550387 @default.
- W3026766095 hasRelatedWork W2089555597 @default.
- W3026766095 hasRelatedWork W2595117888 @default.
- W3026766095 hasRelatedWork W2604758413 @default.
- W3026766095 isParatext "false" @default.
- W3026766095 isRetracted "false" @default.
- W3026766095 magId "3026766095" @default.
- W3026766095 workType "dissertation" @default.