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List of works by Mário T. S. Rosado

Conformational cooling dynamics in matrix-isolated 1,3-butanediol.

scientific article published in July 2009

Conformational study of monomeric 2,3-butanediols by matrix-isolation infrared spectroscopy and DFT calculations.

scientific article

Hydration of cyclohexylamines: CPCM calculation of hydration Gibbs energy of the conformers

scientific article published on 07 April 2007

Pyrazinamide-Diflunisal: A New Dual-Drug Co-Crystal

Structure of isolated 1,4-butanediol: combination of MP2 calculations, NBO analysis, and matrix-isolation infrared spectroscopy.

scientific article published in May 2008

Synthesis of new metalloporphyrin triads: efficient and versatile tripod optical sensor for the detection of amines

scientific article published on 05 August 2011

Synthesis, characterization and biodistribution of bisphosphonates Sm-153 complexes: correlation with molecular modeling interaction studies.

scientific article

The structure of betaxolol from single crystal X-ray diffraction and natural bond orbital analysis

UV-induced radical formation and isomerization of 4-methoxyindole and 5-methoxyindole

scientific article published on 07 October 2020

Vibrationally Induced Conformational Isomerization and Tunneling in Pyrrole-2-Carboxylic Acid

scientific article published on 27 November 2020

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