Palladium orthometallated complexes containing acetophenoneoxime: Synthesis, crystal structures and hirshfeld surface analysis

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dc.contributor.authorBozza, Gabriela F. [UNESP]
dc.contributor.authorde Farias, Renan L. [UNESP]
dc.contributor.authorde Souza, Ronan F.F. [UNESP]
dc.contributor.authorRocha, Fillipe V.
dc.contributor.authorBarra, Carolina V.
dc.contributor.authorDeflon, Victor M.
dc.contributor.authorde Almeida, Eduardo T.
dc.contributor.authorMauro, Antonio E. [UNESP]
dc.contributor.authorNetto, Adelino V.G. [UNESP]
dc.contributor.institutionUniversidade Estadual Paulista (Unesp)
dc.contributor.institutionUniversidade Federal de São Carlos (UFSCar)
dc.contributor.institutionCiência e Tecnologia de São Paulo
dc.contributor.institutionUniversidade de São Paulo (USP)
dc.contributor.institutionInstituto de Química
dc.date.accessioned2019-10-06T16:48:01Z
dc.date.available2019-10-06T16:48:01Z
dc.date.issued2019-01-05
dc.description.abstractThe bridge-splitting reaction between [Pd(C2,N-aphox)(μ-Cl)]2 and phosphines (L), in a 1:2 ratio, yielded neutral mononuclear cyclopalladated compounds of the type [PdCl(C2,N-aphox)(L)] {aphox = acetophenoneoxime; L = triphenylphosphine (1), tris(4-fluorophenyl)phosphine (2), tri-cyclohexylphosphine (3), diphenyl(p-toluyl)phosphine (4), tris-(4-methoxyphenyl)phosphine (5) and tri(p-toluyl)phosphine (6)}. The compounds were characterized by elemental analyses, IR and 1H-, 13C{1H}- and 31P{1H}-NMR spectroscopies. The crystal and molecular structures of 1–5 were determined by single-crystal X-ray diffraction. After that, the Hirshfeld surface calculations were carried out to explore the nature and major contributions of different intermolecular contacts towards crystal packing stability.en
dc.description.affiliationUNESP - Univ Estadual Paulista Institute of Chemistry
dc.description.affiliationUFSCar Univ Federal de São Carlos Departamento de Química
dc.description.affiliationInstituto Federal de Educação Ciência e Tecnologia de São Paulo, Campus Araraquara
dc.description.affiliationInstituto de Química de São Carlos Universidade de São Paulo
dc.description.affiliationUNIFAL - MG - Univ Federal de Alfenas Instituto de Química
dc.description.affiliationUnespUNESP - Univ Estadual Paulista Institute of Chemistry
dc.description.sponsorshipCoordenação de Aperfeiçoamento de Pessoal de Nível Superior (CAPES)
dc.description.sponsorshipFundação de Amparo à Pesquisa do Estado de São Paulo (FAPESP)
dc.description.sponsorshipConselho Nacional de Desenvolvimento Científico e Tecnológico (CNPq)
dc.description.sponsorshipIdFAPESP: 2012/15486-3
dc.description.sponsorshipIdFAPESP: 2014/11340-0
dc.description.sponsorshipIdFAPESP: 2016/17711-5
dc.description.sponsorshipIdCNPq: 422105/2016-3
dc.format.extent195-207
dc.identifierhttp://dx.doi.org/10.1016/j.molstruc.2018.07.108
dc.identifier.citationJournal of Molecular Structure, v. 1175, p. 195-207.
dc.identifier.doi10.1016/j.molstruc.2018.07.108
dc.identifier.issn0022-2860
dc.identifier.scopus2-s2.0-85053035947
dc.identifier.urihttp://hdl.handle.net/11449/189662
dc.language.isoeng
dc.relation.ispartofJournal of Molecular Structure
dc.rights.accessRightsAcesso aberto
dc.sourceScopus
dc.subjectCrystal structure
dc.subjectCyclopalladated compounds
dc.subjectHirshfeld surface analysis
dc.subjectOximes
dc.titlePalladium orthometallated complexes containing acetophenoneoxime: Synthesis, crystal structures and hirshfeld surface analysisen
dc.typeArtigo
unesp.author.lattes3300223970814448[8]
unesp.author.orcid0000-0002-0057-7964[9]

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