Design and Synthesis of Crown Ether Thiosemicarbazones

dc.contributor.affiliationUniversidade de Santiago de Compostela. Departamento de Química Inorgánicagl
dc.contributor.authorLucio Martínez, Fátima
dc.contributor.authorMunín Cruz, Paula
dc.contributor.authorReigosa Chamorro, Francisco
dc.contributor.authorFernández Figueiras, Adolfo
dc.contributor.authorPolo Ces, Paula María
dc.contributor.authorPereira Lorenzo, María Teresa
dc.contributor.authorVila Abad, José Manuel
dc.date.accessioned2021-04-12T08:19:53Z
dc.date.available2021-04-12T08:19:53Z
dc.date.issued2016
dc.descriptionThe 20th International Electronic Conference on Synthetic Organic Chemistry session Computational Chemistrygl
dc.description.abstractThiosemicarbazones are well known compounds that show antitumoral and antibacterial proprieties[1] ; while crown ether moiety acts as ion sensor to entrap cations size-selectively from the environment, implied in the production of sensors, membrane ion transport or potential anti-cancerous species, among others[2]. The combination of both functions into the same molecule should increase their unique applications. Herein we report on the synthesis of a molecule that combines both functions. The main aspect is that the study has being performed beginning with the design of the compound using DFT calculations, with the package of programs g09[3], after which follows the final synthesis and characterization using 1H NMR, IR and crystallographic analysisgl
dc.description.sponsorshipWe wish to thank the financial support received from the Xunta de Galica (Galicia, Spain) under the Grupos de Referencia Competitiva Programme Projects GRC2015/009. F.Lucio thanks the Spanish Ministry of Education (grant FPU13/05014)gl
dc.identifier.citationLucio-Martínez, F., Munín, P., Reigosa, F., Fernández-Figueiras, A., Polo-Ces, P., Pereira, M.T. & Vila, J.M. (2016). Design and Synthesis of Crown Ether Thiosemicarbazones. In J.A. Seijas, M.P. Vázquez Tato & S.K. Lin. (Ed.), Proceedings ECSOC-20: The 20Th International Electronic Conference On Synthetic Organic Chemistry: November 1-30, 2016. MDPI. doi: 10.3390/ecsoc-20-e013gl
dc.identifier.doi10.3390/ecsoc-20-e013
dc.identifier.isbn978-3-03842-192-4
dc.identifier.urihttp://hdl.handle.net/10347/25747
dc.language.isoenggl
dc.publisherMDPIgl
dc.relation.ispartofseriesElectronic Conference on Synthetic Organic Chemistry;20
dc.relation.publisherversionhttps://doi.org/10.3390/ecsoc-20-e013gl
dc.rights© 2016 by MDPI, Basel, Switzerland. Open Accessgl
dc.rights.accessRightsopen accessgl
dc.subjectDFTgl
dc.subjectCrown Ethersgl
dc.subjectThiosemicarbazonesgl
dc.titleDesign and Synthesis of Crown Ether Thiosemicarbazonesgl
dc.typebook partgl
dspace.entity.typePublication
relation.isAuthorOfPublication1be489a9-3c3c-4792-a2ac-84166a3196d3
relation.isAuthorOfPublication40aad724-18ad-4674-ac58-21c42175f7da
relation.isAuthorOfPublication87debb6c-6b40-4195-a8fe-bb89e934ea64
relation.isAuthorOfPublication.latestForDiscovery40aad724-18ad-4674-ac58-21c42175f7da

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