Browsing by Author Rosado, Mário Túlio dos Santos


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Issue DateTitleAuthor(s)TypeAccess
2-Jul-2009Conformational Cooling Dynamics in Matrix-Isolated 1,3-ButanediolRosado, Mário T. S. ; Jesus, António J. Lopes ; Reva, Igor D. ; Fausto, Rui ; Redinha, José S. articleopenAccess
2005Conformational study of erythritol and threitol in the gas state by density functional theory calculationsJesus, António J. Lopes ; Tomé, Luciana I. N. ; Rosado, Mário Túlio S. ; Leitão, M. Luísa P. ; Redinha, José S. articleopenAccess
2007Conformational study of isolated pindolol by HF, DFT and MP2 calculationsNunes, Sandra C. C. ; Jesus, A. J. Lopes ; Rosado, Mário Túlio S. ; Eusébio, M. Ermelinda S. articleopenAccess
30-Mar-2006Conformational Study of Monomeric 2,3-Butanediols by Matrix-Isolation Infrared Spectroscopy and DFT CalculationsJesus, A. J. Lopes ; Rosado, Mário T. S. ; Reva, Igor ; Fausto, Rui ; Eusébio, M. Ermelinda ; Redinha, J. S. articleopenAccess
Sep-2010Design e síntese de aminoácidos derivados do 3-vinil-1H-indol via hidroformilação catalítica para o desenvolvimento de potenciais adoçantes. Modelação molecular dos ligandos e catalisadores de ródioLourenço, Mirtha Alejandra de Oliveira. masterThesisopenAccess
2007Enthalpy of sublimation/vaporization of trans-cyclohexyl-1,4-diamine and cis-cyclohexyl-1,2-diamineTomé, Luciana I. N. ; Rosado, Mário T. S. ; Nunes, Sandra C. C. ; Maria, Teresa M. R. ; Canotilho, João ; Eusébio, M. Ermelinda S. articleopenAccess
Sep-2010Estudos de formação de co-cristais com o diflunisal e isómeros de piridina-carboxamidaForte, Carina Alexandra Dinis masterThesisopenAccess
2011Isómeros de ciclo-hexanodiol : conformação molecular e polimorfismoBebiano, Suse Vanessa dos Santos masterThesisopenAccess
Jan-1998Matrix-Isolation Infrared and Theoretical Studies of the Glycine ConformersStepanian, S.G. ; Reva, I.D. ; Radchenko, E.D. ; Rosado, M.T.S. ; Duarte, M.L.T.S. ; Fausto, R. ; Adamowicz, L. articleopenAccess
Oct-2014Molecular structure and polymorphism of a cyclohexanediol: trans-1,4-cyclohexanedimethanolRosado, Mário T. S. ; Maria, Teresa M. R. ; Castro, Ricardo A. E. ; Canotilho, João ; Silva, Manuela Ramos ; Eusébio, M. Ermelinda S. articleopenAccess
15-May-2003Molecular Structure of Butanediol Isomers in Gas and Liquid States: Combination of DFT Calculations and Infrared Spectroscopy StudiesJesus, A. J. Lopes ; Rosado, Mário T. S. ; Leitão, M. Luísa P. ; Redinha, José S. articleopenAccess
2007Molecular structure of mono- and 1,2-aminoderivatives of cyclohexane: Steric strain effects as determining factorsTomé, Luciana I. N. ; Rosado, Mário T. S. ; Eusébio, M. Ermelinda S. ; Redinha, J. S. articleopenAccess
20-Sep-2018Polimorfismo, estrutura e capacidade de formação de cristais plásticos de dióis globularesSilva, Joana Filipa Carvalho da masterThesisopenAccess
24-Jul-2017SPECTROSCOPIC APPROACHES FOR FORENSIC PROBLEMS Identification of pre-blast explosive residues and energetic materials by Raman spectroscopyQuintela, Diogo Manuel Videira masterThesisopenAccess
20-Oct-2006Stepwise conformational cooling towards a single isomeric state in the four internal rotors system 1,2-butanediolReva, Igor D. ; Jesus, António J. Lopes ; Rosado, Mário T. S. ; Fausto, Rui ; Eusébio, M. Ermelinda ; Redinha, J. S. articleopenAccess
1-Sep-2008The structure of betaxolol from single crystal X-ray diffraction and natural bond orbital analysisCanotilho, João ; Castro, Ricardo A. E. ; Rosado, Mário T. S. ; Silva, M. Ramos ; Beja, A. Matos ; Paixão, J. A. ; Redinha, J. Simões articleopenAccess
22-May-2008Structure of Isolated 1,4-Butanediol: Combination of MP2 Calculations, NBO Analysis, and Matrix-Isolation Infrared SpectroscopyJesus, A. J. Lopes ; Rosado, Mário T. S. ; Reva, Igor ; Fausto, Rui ; Eusébio, M. Ermelinda S. ; Redinha, J. S. articleopenAccess
1-Sep-2008Structure of the 2-isopropylaminoethanol isolated molecule: Conformational analysis and intramolecular interactionsNunes, Sandra C. C. ; Eusébio, M. Ermelinda S. ; Jesus, A. J. Lopes ; Rosado, Mário T. S. ; Redinha, J. S. articleopenAccess
2002Synthesis, characterization and biodistribution of bisphosphonates Sm-153 complexes: correlation with molecular modeling interaction studiesNeves, M. ; Gano, L. ; Pereira, N. ; Costa, M. C. ; Costa, M. R. ; Chandia, M. ; Rosado, M. ; Fausto, R. articleopenAccess
16-Jun-1997Vibrational spectra (FT-IR, Raman and MI-IR) of α- and β-alanineRosado, Mário Túlio S. ; Duarte, Maria Leonor R.S. ; Fausto, Rui articleopenAccess