Raman and Infrared spectroscopies and X-ray diffraction data on bupivacaine and ropivacaine complexed with 2-hydroxypropyl-β-cyclodextrin

Murillo L Martins; Juergen Eckert; Henrik Jacobsen; Everton C Dos Santos; Rosanna Ignazzi; Daniele Ribeiro de Araujo; Marie-Claire Bellissent-Funel; Francesca Natali; Michael Marek Koza; Aleksander Matic; Eneida de Paula; Heloisa N Bordallo

doi:10.1016/j.dib.2017.08.053

Raman and Infrared spectroscopies and X-ray diffraction data on bupivacaine and ropivacaine complexed with 2-hydroxypropyl-β-cyclodextrin

Data Brief. 2017 Sep 4:15:25-29. doi: 10.1016/j.dib.2017.08.053. eCollection 2017 Dec.

Authors

Affiliations

¹ Niels Bohr Institute, University of Copenhagen, Universitetsparken 5 DK-2100, Copenhagen, Denmark.
² Department of Chemistry, University of South Florida, 4202 E. Fowler Ave., Tampa, FL 33620, United States.
³ Theoretical Division, Los Alamos National Laboratory, Los Alamos, NM 87545, United States.
⁴ Department of Physics, Norwegian University of Science and Technology (NTNU), Høgskoleringen 5 NO-7491, Trondheim, Norway.
⁵ Human and Natural Sciences Center Federal University of ABC (UFABC), 09210-170 Santo André, SP, Brazil.
⁶ LLB, CEA, CNRS, Université Paris-Saclay, CEA Saclay, 91191 Gif-sur-Yvette, France.
⁷ Institute of Materials, Research National Council (CNR-IOM), Italy.
⁸ Institut Laue-Langevin, BP 156, F-38042 Grenoble Cedex 9, France.
⁹ Department of Applied Physics, Chalmers University of Technology, SE-41296 Göteborg, Sweden.
¹⁰ Department of Biochemistry and Tissue Biology, State University of Campinas (UNICAMP), 13083-862 Campinas, SP, Brazil.
¹¹ European Spallation Source ESS AB, P.O. Box 176, SE-22100 Lund, Sweden.

Abstract

The data presented in this article are related to the research article entitled "Probing the dynamics of complexed local anesthetics via neutron scattering spectroscopy and DFT calculations (http://dx.doi.org/10.1016/j.ijpharm.2017.03.051)" (Martins et al., 2017) [1]. This work shows the molecular and structural behavior of the local anesthetics (LAs) bupivacaine (BVC, C₁₈H₂₈N₂O) and ropivacaine (RVC, C₁₇H₂₆N₂O) before and after complexation with the water-soluble oligosaccharide 2-hydroxypropyl-β-cyclodextrin (HP-β-CD).