Please use this identifier to cite or link to this item: https://hdl.handle.net/10316/99968
DC FieldValueLanguage
dc.contributor.authorFausto, Rui-
dc.contributor.authorOgruc Ildiz, Gulce-
dc.contributor.authorBrás, Elisa Cristina Marçalo-
dc.contributor.authorNogueira, Bernardo Albuquerque-
dc.date.accessioned2022-04-26T11:51:27Z-
dc.date.available2022-04-26T11:51:27Z-
dc.date.issued2018-10-11-
dc.identifier.urihttps://hdl.handle.net/10316/99968-
dc.description.abstractIn this Chapter, we highlight the power of vibrational spectroscopy as central technique to investigate the structure and reactivity of two relevant families of nitrogen-containing heterocyclic molecules: hydantoins, and mercaptoimidazoles. Infrared spectroscopy is used in connection with the matrix isolation technique to investigate the structures of the isolated molecules and their photochemistry, while both infrared and Raman spectroscopies, supplemented by thermodynamics, microscopy and diffraction techniques, are used to investigate neat condensed phases of the compounds and transitions between these phases. The experimental studies are supported by extensive computational studies, which include several approaches for detailed analysis of the electron density.pt
dc.language.isoengpt
dc.publisherSpringerpt
dc.relationPTDC/QEQ-QFI/3284/2014pt
dc.relationPOCI-01-0145-FEDER-016617pt
dc.relationCCMAR/BI/0013/2017pt
dc.relationPTDC/MAR-BIO/4132/2014pt
dc.relationSFRH/BD/129852/2017pt
dc.rightsopenAccesspt
dc.titleHydantoins and Mercaptoimidazolespt
dc.title.alternativeVibrational Spectroscopy as a Probe of Structure and Reactivity in Different Environments, from the Isolated Molecule to Polymorphspt
dc.typebookPartpt
degois.publication.firstPage199pt
degois.publication.lastPage222pt
degois.publication.titleChallenges and Advances in Computational Chemistry and Physicspt
dc.peerreviewedyespt
dc.date.embargo2018-10-11*
uc.date.periodoEmbargo0pt
item.openairecristypehttp://purl.org/coar/resource_type/c_18cf-
item.openairetypebookPart-
item.cerifentitytypePublications-
item.grantfulltextopen-
item.fulltextCom Texto completo-
item.languageiso639-1en-
crisitem.author.researchunitCQC - Coimbra Chemistry Centre-
crisitem.author.researchunitCQC - Coimbra Chemistry Centre-
crisitem.author.researchunitFaculty of Sciences and Technology-
crisitem.author.parentresearchunitFaculty of Sciences and Technology-
crisitem.author.parentresearchunitFaculty of Sciences and Technology-
crisitem.author.parentresearchunitUniversity of Coimbra-
crisitem.author.orcid0000-0002-8264-6854-
crisitem.author.orcid0000-0002-7827-5050-
crisitem.author.orcid0000-0002-1756-377X-
Appears in Collections:I&D CQC - Livros e capítulos de livros
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