{"id":71,"date":"2018-09-06T19:44:29","date_gmt":"2018-09-06T22:44:29","guid":{"rendered":"http:\/\/cormanich.iqm.unicamp.br\/?page_id=71"},"modified":"2026-07-09T21:17:05","modified_gmt":"2026-07-10T00:17:05","slug":"publications-2","status":"publish","type":"page","link":"https:\/\/cormanich.iqm.unicamp.br\/?page_id=71","title":{"rendered":"Publications"},"content":{"rendered":"\n<hr class=\"wp-block-separator has-alpha-channel-opacity is-style-default\"\/>\n\n\n<h3><strong>2026<\/strong><\/h3>\n<p>J. Stewart; B. A Piscelli; D. B. Cordes; R. A. Cormanich; D. O&#8217;Hagan &#8220;Incorporation and properties of the tris-fluoromethylated motif into heterocycles, amino acids and analogues of elexacaftor and tezacaftor&#8221; <em>Chemical Science<\/em>, <strong>2026<\/strong>. <a href=\"https:\/\/doi.org\/10.1039\/D6SC04239B\">https:\/\/doi.org\/10.1039\/D6SC04239B<\/a><\/p>\n<p>B. A. Piscelli, C. E. V. P. Nascimento, R. A. Cormanich &#8220;How Fluorination Collapses Inversion Barriers and Increases Electrophilicity in Bicyclo[1.1.0]butanes&#8221;\u00a0<em>Phys. Chem. Chem. Phys.<\/em>\u00a0<strong>2026<\/strong>.<a href=\"https:\/\/doi.org\/10.1039\/D6CP01952H\">https:\/\/doi.org\/10.1039\/D6CP01952H<\/a><\/p>\n<p>E. Kucukefe, R. A. Cormanich, S. P. A. Sauer &#8220;Benchmarking B3LYP, PBE0 and M06L for nuclear spin\u2013spin couplings against CC3: influence of geometry optimization&#8221; <em>Phys. Chem. Chem. Phys.<\/em> <strong>2026<\/strong>, <em>28<\/em>, 13196-13207. <a href=\"https:\/\/doi.org\/10.1039\/D6CP00842A\">https:\/\/doi.org\/10.1039\/D6CP00842A<\/a><\/p>\n<p>B. A. Piscelli, L. A. Zeoly, R. A. Cormanich, M. P. Freitas &#8220;Perlin- and Bohlmann-type effects in cyclohexylamine and 1-aminopiperidine derivatives&#8221; <em>Phys. Chem. Chem. Phys.<\/em> <strong>2026, <\/strong><em>28<\/em><strong>, <\/strong>6365-6376. <a href=\"http:\/\/doi.org\/10.1039\/d5cp04783h\">http:\/\/doi.org\/10.1039\/d5cp04783h<\/a><\/p>\n<p>B. A. Piscelli, M. A. S. Afonso, K. T. Miyake, R. A. Cormanich &#8220;Stereoelectronic Control of Conformation and Reactivity in Substituted Disulfides&#8221; <em>Tetrahedron <\/em><strong>2026<\/strong>, <em>195<\/em>, 135239. <a href=\"https:\/\/doi.org\/10.1016\/j.tet.2026.135239\">https:\/\/doi.org\/10.1016\/j.tet.2026.135239<\/a><\/p>\n<h3><strong>2025<\/strong><\/h3>\n<p>B. A. Piscelli, M. B\u00fchl, R. A. Cormanich, D. O&#8217;Hagan &#8220;On the Nature of Improper Hydrogen Bonding in RCH2F and RCHF2 Motifs&#8221; <em>Angewandte Chemie International Edition<\/em>\u00a0<strong>2025<\/strong>, e202518500. <a href=\"http:\/\/doi.org\/10.1002\/anie.202518500\">http:\/\/doi.org\/10.1002\/anie.202518500<\/a><\/p>\n<p>H. V. Almeida, L. C. E. da Silva, B. A. Piscelli, B. R. G. dos Santos, D. M. Guizoni, A. P. Davel, R. A. Cormanich and M. G. de Oliveira &#8220;Nitric oxide-releasing PHEMA\/polysilsesquioxane photocrosslinked hybrids&#8221; <em>RSC Advances<\/em>, <strong>2025<\/strong>, <em>15<\/em>, 45048. <a href=\"https:\/\/doi.org\/10.1039\/D5RA07870A\">https:\/\/doi.org\/10.1039\/D5RA07870A<\/a><\/p>\n<p>B. A. Piscelli, T. Swithenbank-Michel, R. A. Cormanich, D. O&#8217;Hagan, M. Buehl &#8220;Performance of Semiempirical DFT Methods for the Supramolecular Assembly of Janus-Face Cyclohexanes&#8221; <em>Physical Chemistry Chemical Physics<\/em>,\u00a0<strong>2025<\/strong>, <em>27<\/em>, 23336-23347<a href=\"https:\/\/doi.org\/10.1039\/D5CP02879E\">\u00a0https:\/\/doi.org\/10.1039\/D5CP02879E<\/a><\/p>\n<p>T. S. Silva, J. T. M. Correia, B. A. Piscelli, R. A. Cormanich, B. List, F. Coelho &#8220;Catalyst-Dependent Asymmetric Dearomative and Desymmetrizative Higher-Order [8 + 2] Cycloaddition of Indolizines with Maleimides toward the Atroposelective Synthesis of Cyclazines&#8221; <em>ACS Catalysis <strong>2025<\/strong>, 15, 15, 13558\u201313567<\/em>. <a href=\"https:\/\/doi.org\/10.1021\/acscatal.5c03020\">https:\/\/doi.org\/10.1021\/acscatal.5c03020<\/a><\/p>\n<p>T. A. B. Chagas,\u00a0 B. A. Piscelli, H. Santos, S. R. Lima, R. A. Cormanich, F. S. Fernandes, F. Coelho &#8220;An asymmetric and theoretical approach to the Morita\u2013Baylis\u2013Hillman reaction using vinyl-1,2,4-oxadiazoles as nucleophiles&#8221; <em>Organic &amp; Biomolecular Chemistry<\/em>, <strong>2025<\/strong>, <em>23<\/em>, 5872. <a href=\"https:\/\/doi.org\/10.1039\/D5OB00540J\">https:\/\/doi.org\/10.1039\/D5OB00540J<\/a><\/p>\n<p>R. M. S. Souza, T. A. C. Goulart, R. C. Pinheiro, F. F. C. Sonaglio, D. A. Simoni, R. A. Cormanich, I. D. Jurberg &#8220;Visible Light-Mediated Preparation of a Key Intermediate Employed in the Synthesis of Zolpidem and Several Analogs&#8221;\u00a0\u00a0<em>Chemistry &#8211; An Asian Journal<\/em>, <strong>2025<\/strong>, <em>0<\/em>, e004552025.\u00a0<a href=\"https:\/\/doi.org\/10.1002\/asia.202500455\">https:\/\/doi.org\/10.1002\/asia.202500455\u00a0<\/a><\/p>\n<p>D. Bhattacherjee, B. M. Kariuki, B. A. Piscelli, R. A. Cormanich, T. Wirth &#8220;Synthesis and Reactivity of Six-Membered Cyclic Diaryl \u03bb3-Bromanes and \u03bb3-Chloranes&#8221; <em>Angewandte Chemie <\/em>\u00a0<strong>2025<\/strong>, <em>64<\/em>, e202424559 <a href=\"https:\/\/doi.org\/10.1002\/anie.202424559\">https:\/\/doi.org\/10.1002\/anie.202424559<\/a><\/p>\n<p>G. Cariello, R. D. C. Gallo, V. M. Deflon, R. A. Cormanich, I. D. Jurberg &#8220;Visible Light-Mediated Formal Alkylation and [4+1]-Cycloaddition Strategies of Silyl Enol Ethers with Aryldiazoacetates&#8221; <em>Chemical Communications<\/em>, <strong>2025<\/strong>, <em>61<\/em>, 2044<b>.<\/b>\u00a0<a href=\"https:\/\/doi.org\/10.1039\/D4CC05451B\">https:\/\/doi.org\/10.1039\/D4CC05451B<\/a><\/p>\n<h3><strong>2024<br \/><\/strong><\/h3>\n<p>T. J. Poskin, B. A. Piscelli, A. P. McKay, D. B. Cordes, Y. Eushi, S. Yamada, R. A. Cormanich, D. O\u2019Hagan &#8220;Synthesis of Janus All-Cis Tetrafluorocyclohexanes Carrying 1,4-Diether Motifs&#8221; The <em>Journal of Organic Chemistry<\/em> <strong>2024<\/strong>, <em>89<\/em>, 18445\u201318451 <a href=\"https:\/\/doi.org\/10.1021\/acs.joc.4c02345\">https:\/\/doi.org\/10.1021\/acs.joc.4c02345<\/a><\/p>\n<p>M. Giovanetti, R. A. Cormanich, S. P. A. Sauer &#8220;On the Performance of Second-Order Polarization Propagator Methods in the Calculation of 1JFC and nJFH NMR Spin\u2013Spin Coupling Constants&#8221;<em> Journal of Chemical Theory and Computation<\/em>\u00a0<strong>2024<\/strong>, <em>20<\/em>, 10453\u221210467 <a href=\"https:\/\/doi.org\/10.1021\/acs.jctc.4c01043\">https:\/\/doi.org\/10.1021\/acs.jctc.4c01043<\/a><\/p>\n<p style=\"text-align: left;\"><span class=\"hlFld-ContribAuthor\" tabindex=\"0\" data-id=\"article_author_info\">D. Leparfait, <\/span>T. Thierry, N. L. da Rocha, R. L., E. Pfund, <span class=\"hlFld-ContribAuthor\" tabindex=\"0\" data-id=\"article_author_info\">R. A. Cormanich<\/span><strong>, <\/strong><span class=\"hlFld-ContribAuthor\" tabindex=\"0\" data-id=\"article_author_info\">T. Lequeux <\/span>&#8220;Stereoselective Ring-Opening Reaction of \u03b1-Fluorinated Oxetanes: A Practical and Theoretical Investigation&#8221; The\u00a0<em>Journal of Organic Chemistry\u00a0<\/em><strong>2024<\/strong>, <em>89<\/em>, 17194\u201317206 <a href=\"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.joc.4c01698\">https:\/\/pubs.acs.org\/doi\/10.1021\/acs.joc.4c01698<\/a><\/p>\n<p>A. Tarui, B. A. Piscelli, N. Al-Maharik, J. M. Stewart, P. Niemcova, D. B. Cordes, A. P. McKay, C. Murphy, R. A. Cormanich, D. O&#8217;Hagan &#8220;Synthesis and Analysis of (g,g&#8217;, g&#8221;, &#8211; Trifluoro)neopentyl (TFNP)Aryl ethers as a Polar Aliphatic Motif&#8221; <em>Chemistry a European Journal<\/em> <strong>2024<\/strong>, e202402532.\u00a0 <a href=\"https:\/\/doi.org\/10.1002\/chem.202402532\">https:\/\/doi.org\/10.1002\/chem.202402532<\/a><\/p>\n<p>R. A. Cormanich, G. D. da Silva &#8220;Autobench V1.0: Benchmarking Automation for Electronic Structure Calculations&#8221; <em>Journal of Chemical Information and Modeling<\/em>\u00a0<strong>2024, <\/strong><span class=\"cit-volume\"><em>64<\/em><\/span><strong><span class=\"cit-issue\">, <\/span><\/strong><span class=\"cit-pageRange\">3322\u20133331.<\/span> <a href=\"https:\/\/doi.org\/10.1021\/acs.jcim.4c00250\" target=\"_blank\" rel=\"noopener\">https:\/\/doi.org\/10.1021\/acs.jcim.4c00250<\/a><\/p>\n<p>M. He, B. A. Piscelli, R. A. Cormanich and D. O\u2019Hagan &#8220;Conformational Analysis Explores the Role of Electrostatic Nonclassical CF\u00b7\u00b7\u00b7HC Hydrogen Bonding Interactions in Selectively Halogenated Cyclohexanes&#8221; <em>The Journal of Organic Chemistry <\/em><strong>2024, <\/strong><em>89<\/em>, 4009-4018. <a href=\"https:\/\/doi.org\/10.1021\/acs.joc.3c02868\" target=\"_blank\" rel=\"noopener\">https:\/\/doi.org\/10.1021\/acs.joc.3c02868<\/a><\/p>\n<h3><strong>2023<\/strong><\/h3>\n<p>G. Cariello, L. A. Zeoly, B. A. Piscelli, T. Lectka, R. A. Cormanich &#8220;The pitfalls of using JHF spin\u2013spin coupling constants to infer hydrogen bond formation in organofluorine compounds&#8221;\u00a0<em>Chemical Communications <\/em><strong>2023, <\/strong><em>59<\/em>, 14661-14664. <a href=\"https:\/\/doi.org\/10.1039\/D3CC05389J\" target=\"_blank\" rel=\"noopener\">https:\/\/doi.org\/10.1039\/D3CC05389J<\/a><\/p>\n<p>N. G. Garrison, S. A. Harry, M. A. Siegler, G. Cariello, R. A. Cormanich, T. Lectka &#8220;The C-F\u22c5\u22c5\u22c5H-CF2 Interaction: A Combination of Hydrogen Bonding and n\u202f\u2192\u202f\u03c3* Stabilization&#8221;\u00a0<em>Journal of Fluorine Chemistry<\/em>\u00a0<strong>2023<\/strong>, <em>272<\/em>, 110191.\u00a0<a href=\"https:\/\/doi.org\/10.1016\/j.jfluchem.2023.110191\" target=\"_blank\" rel=\"noopener\">https:\/\/doi.org\/10.1016\/j.jfluchem.2023.110191<\/a><\/p>\n<p>L. S. Dobson, Q. Zhang, B. A. McKay, O. Oke, C. Isanbor, M. F. Khan, B. A. Piscelli, D. B. Cordes, R. A. Cormanich, C. D. Murphy, D. O\u2019Hagan &#8220;Aryl (\u03b2,\u03b2\u2032,\u03b2\u2033-Trifluoro)-tert-butyl: A Candidate Motif for the Discovery of Bioactives&#8221; <em>Organic Letters<\/em>\u00a0<strong>2023<\/strong>, <em>25<\/em>, 6802\u20136807. <a href=\"https:\/\/doi.org\/10.1021\/acs.orglett.3c02236\" target=\"_blank\" rel=\"noopener\">https:\/\/doi.org\/10.1021\/acs.orglett.3c02236<\/a><\/p>\n<p>D. R. Silva, L. A. Zeoly, P. Vermeeren, R. A. Cormanich, T. A. Hamlin, C. F. Guerra, M. P. Freitas &#8220;Solvent effects on the sodium borohydride reduction of 2-halocyclohexanones&#8221; <em>Journal of Physical Organic Chemistry <\/em><strong>2023<\/strong>, <em>36, <\/em><strong>e4556. <\/strong><a href=\"https:\/\/doi.org\/10.1002\/poc.4556\" target=\"_blank\" rel=\"noopener\">https:\/\/doi.org\/10.1002\/poc.4556<\/a><\/p>\n<p>L. A. Zeoly, L. V. Acconcia, M. T. Rodrigues Jr., H. Santos, R. A. Cormanich, J. C. Paniagua, A. Moyano, F. Coelho &#8220;One-pot organocatalyzed synthesis of tricyclic indolizines&#8221; <em>Organic &amp; Biomolecular Chemistry <\/em><strong>2023<\/strong><em>, 21,<\/em> 3567\u20133581. <a href=\"https:\/\/doi.org\/10.1039\/D3OB00346A\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1039\/D3OB00346A<\/a><\/p>\n<p>B. A. Piscelli, D. O&#8217;Hagan, R. A. Cormanich &#8220;Contribution of Hyperconjugation and Inductive Effects to the Pseudo-anomeric Effect in 4-Substituted Methoxycyclohexanes&#8221;\u00a0<em>Journal of Physical Chemistry A\u00a0<\/em><strong>2023<\/strong>, <em>127<\/em>, 724-728. <a href=\"https:\/\/doi.org\/10.1021\/acs.jpca.2c08090\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1021\/acs.jpca.2c08090<\/a><\/p>\n<h3><strong>2022<\/strong><\/h3>\n<p>G. R. Gomes, E. Scopel, N. L. Rocha, M. C. Breitkreitz, R. A. Cormanich, C. A. Rezende, J. C. Pastre &#8220;Direct Ethyl Levulinate Production from Raw Lignocellulosic Biomass Mediated by a Novel Taurine-Based Imidazolium Ionic Liquid&#8221; <em>ACS Sustainable Chemistry &amp; Engineering\u00a0<\/em><strong>2022<\/strong>, <em>10<\/em>, 15876-15888. <a href=\"https:\/\/doi.org\/10.1021\/acssuschemeng.2c05172\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1021\/acssuschemeng.2c05172<\/a><\/p>\n<p><span class=\"bold\">C. Yu,<\/span> B. A. <span class=\"bold\">Piscelli,<\/span> N. A. <span class=\"bold\">Maharik, D. B.<\/span>\u00a0<span class=\"bold\">Cordes<\/span>, A. M. Z. <span class=\"bold\">Slawin<\/span>, R. A. <span class=\"bold\">Cormanich, D.<\/span>\u00a0<span class=\"bold\">O&#8217;Hagan <\/span>&#8220;Unexpected triaxial preferences in some all-syn 1,3,5-trifluorocyclohexanes&#8221; <em>Chemical Communications<\/em>\u00a0<strong>2022<\/strong>, <em>58<\/em>, 12855-12858. <a href=\"https:\/\/doi.org\/10.1039\/D2CC05058G\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1039\/D2CC05058G<\/a><\/p>\n<p>J. N. Bezerra, J. P. M. Spadeto, J. K. Dar\u00e9, W. P. Almeida, M. P. Freitas, R. A. Cormanich<strong>\u00a0\u201c<\/strong>In Silico Interactions of the Components from the Schinus terebinthifolius Extract with Human Tyrosinase\u201d <em>ChemPlusChem. <\/em><strong>2022<\/strong>,<em> 87, <\/em>e202200109. <a href=\"https:\/\/doi.org\/10.1002\/cplu.202200109\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1002\/cplu.202200109<\/a><\/p>\n<p>T. J. Poskin, B. A. Piscelli, K. Yoshida, D. B. Cordes, A. M. Z. Slawin, R. A. Cormanich, S. Yamada, D. O&#8217;Hagan \u201cJanus faced fluorocyclohexanes for supramolecular assembly: Synthesis and solid state structures of equatorial mono-, di- and tri alkylated cyclohexanes and with tri-axial C-F bonds to impart polarity.\u201d <em>Chemical Communications<\/em>\u00a0<strong>2022<\/strong>, <em>58<\/em>, 7968-7971. <a href=\"https:\/\/doi.org\/10.1039\/D2CC03010A\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1039\/D2CC03010A<\/a><\/p>\n<p>H. Zhang, R. A. Cormanich, T. Wirth &#8220;Chiral Ligands in Hypervalent Iodine Compounds: Synthesis and Structures of Binaphthyl-based \u03bb3-Iodanes&#8221; <em>Chemistry: A European Journal<\/em>\u00a0<strong>2022<\/strong>, <em>28<\/em>, e202103623. <a href=\"https:\/\/doi.org\/10.1002\/chem.202103623\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1002\/chem.202103623<\/a><\/p>\n<p class=\"font_0\"><span class=\"color_15\">M. L. Stivanin, R. D. C. Gallo, J. P. M. Spadeto, R. A. Cormanich, I. D. Jurberg &#8220;A Visible Light-Mediated Three-Component Strategy Based on the Ring-Opening of Cyclic Ethers with Aryldiazoacetates and Nucleophiles&#8221; <em>Organic Chemistry Frontiers<\/em>\u00a0<strong>2022<\/strong>, <em>9<\/em>, 1321-1326.<\/span>\u00a0<a href=\"https:\/\/doi.org\/10.1039\/D1QO01780B\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1039\/D1QO01780B<\/a><\/p>\n<p>J. P. M. Spadeto, R. A. Cormanich, T. C. C. Franca, S. R. LaPlante, A. S. Goncalves &#8220;Docking and molecular dynamics studies of potential new leads against DBL3x derived from chondroitin sulfate A (CSA): a new approach for the treatment of malaria&#8221; <em>Journal of Biomolecular Structure and Dynamics <\/em><strong>2022<\/strong><em>, 40, 8384\u20138393<\/em><a href=\"https:\/\/doi.org\/10.1080\/07391102.2021.1911859\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1080\/07391102.2021.1911859<\/a><\/p>\n<h3><strong>2021<\/strong><\/h3>\n<p>M. Giovannetti, L. F. F. Bitencourt, R. A. Cormanich, S. Sauer &#8220;On the Unexpected Accuracy of the M06L Functional in the Calculation of 1JFC Spin\u2212Spin Coupling Constants&#8221;\u00a0<em>Journal of Chemical Theory and Computation\u00a0<\/em><strong>2021<\/strong>, <em>17<\/em>, 7712-7723. <a href=\"https:\/\/doi.org\/10.1021\/acs.jctc.1c00287\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1021\/acs.jctc.1c00287<\/a><\/p>\n<p>J. P. M. Spadeto, M. P. Freitas, R. A. Cormanich &#8220;Fluorinated dihydropyridines as candidates to block L-type voltage-dependent calcium channels&#8221;\u00a0<em>Journal of Biomolecular Structure and Dynamics\u00a0<\/em><strong>2021 <\/strong><a href=\"https:\/\/doi.org\/10.1080\/07391102.2021.1989039\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1080\/07391102.2021.1989039<\/a><\/p>\n<p>L. H. Sim\u00f5es, R. A. Cormanich &#8220;Challenges in studying steric interactions in highly strained perhalogenated alkanes and silanes&#8221; <em>International Journal of Quantum Chemistry<\/em>\u00a0<strong>2021<\/strong>, <em>121<\/em>, e26785. <a href=\"https:\/\/doi.org\/10.1002\/qua.26785\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1002\/qua.26785<\/a><\/p>\n<p>V. C. Port, R. A. Cormanich &#8220;There and back again: the role of hyperconjugation in the fluorine gauche effect&#8221; <em>Physical Chemistry Chemical Physics<\/em> <strong>2021<\/strong>, <em>23<\/em>, 17329-17337. <a href=\"https:\/\/doi.org\/10.1039\/D1CP02806E\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1039\/D1CP02806E<\/a><\/p>\n<p>J. Clark, D. O&#8217;Hagan, S. Guldin, A. Slawin, D. B. Cordes, C. Yu, R. A. Cormanich, R. Neyyappadath, A. Geddis, A. Taylor, B. A. Piscelli &#8220;Supramolecular packing of alkyl substituted Janus face all-cis 2,3,4,5,6-pentafluorocyclohexyl motifs&#8221;\u00a0<em>Chemical Science<\/em><strong>\u00a02021<\/strong>, <em>12<\/em>, 9712-9719. <a href=\"https:\/\/doi.org\/10.1039\/D1SC02130C\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1039\/D1SC02130C<\/a><\/p>\n<p>B. A. Piscelli, D. O&#8217;Hagan, R. A. Cormanich &#8220;The contribution of non-classical CHax\u00b7\u00b7\u00b7OC hydrogen bonds to the anomeric effect in fluoro and oxa-methoxycyclohexanes&#8221;\u00a0<em>Physical Chemistry Chemical Physics\u00a0<\/em><strong>2021<\/strong>, <em>23<\/em>, 5845-5851. <a href=\"https:\/\/doi.org\/10.1039\/D0CP06646J\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1039\/D0CP06646J<\/a><\/p>\n<p>V. C. Port; L. A. Zeoly; F. Coelho; R. A Cormanich &#8220;Through Space JHF Spin-Spin Coupling Constant Transmission Pathways in 2-(Trifluoromethyl)thiophenol: formation of unusual stabilizing bifurcated CF\u2219\u2219\u2219HS and CF\u2219\u2219\u2219SH interactions&#8221; <em>Physical Chemistry Chemical Physics<\/em> <strong>2021<\/strong>, <em>23<\/em>, 9080-9088. <a href=\"https:\/\/doi.org\/10.1039\/D0CP05887D\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1039\/D0CP05887D<\/a><\/p>\n<p>P. H. Vendramini; L. A. Zeoly; R. A. Cormanich; M. Buehl; M. N. Eberlin; B. R. V. Ferreira &#8220;Unveiling the mechanism of N\u2010methylation of indole with dimethylcarbonate using either DABCO or DBU as catalyst&#8221; <i>Journal of Mass Spectrometry <\/i><strong>2021, <\/strong><em>56, <\/em>e4707<strong>.<\/strong> <a href=\"https:\/\/doi.org\/10.1002\/jms.4707\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1002\/jms.4707<\/a><\/p>\n<h3><strong>2020<\/strong><\/h3>\n<p>M. A. S. Afonso; R. A. Cormanich &#8220;The preferred geometry of hydroperoxides is the result of an interplay between electrostatic and hyperconjugative effects&#8221; <em>Physical Chemistry Chemical Physics<\/em>\u00a0<strong>2020<\/strong>,\u00a0<em>22<\/em>, 27173-27177. <a href=\"https:\/\/doi.org\/10.1039\/D0CP04688D\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1039\/D0CP04688D<\/a><\/p>\n<p><span style=\"font-size: inherit;\">R. A. Cormanich; L. A. Zeoly; H. Santos; N. S. Camilo; M. B\u00fchl, F. Coelho, &#8220;Origin of the Diastereoselectivity of the Heterogeneous Hydrogenation of a Substituted Indolizine&#8221; <\/span><em style=\"font-size: inherit;\">The<\/em> <em style=\"font-size: inherit;\">Journal of Organic Chemistry <\/em><strong style=\"font-size: inherit;\">2020<\/strong><span style=\"font-size: inherit;\">, <\/span><em style=\"font-size: inherit;\">85<\/em><span style=\"font-size: inherit;\">, 11541\u221211548. <\/span><a href=\"https:\/\/doi.org\/10.1021\/acs.joc.0c01338\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1021\/acs.joc.0c01338<\/a><\/p>\n<p>B. A Piscelli; W. Sanders; C. Yu; N. A. Maharik; T. Lebl; R. A Cormanich; D. O&#8217;Hagan, &#8220;Fluorine induced pseudo anomeric effects in methoxycyclohexanes through electrostatic 1,3 diaxial interactions.&#8221;, <em>Chemistry: A European Journal<\/em>\u00a0<strong>2020<\/strong>, <em>6<\/em>, 11989 \u201311994. <a href=\"https:\/\/doi.org\/10.1002\/chem.202003058\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1002\/chem.202003058<\/a><\/p>\n<p>A. F. da Silva, M. A. S. Afonso, R. A. Cormanich, I. D. Jurberg, &#8220;Room Temperature Coupling of Aryldiazoacetates with Boronic Acids Enhanced by Blue Light Irradiation.&#8221;,\u00a0<em>Chemistry: A European Journal<\/em>\u00a0<strong>2020<\/strong>, <em>26<\/em>, 5648. <a href=\"https:\/\/doi.org\/10.1002\/chem.201905812\" target=\"_blank\" rel=\"noopener noreferrer\"> https:\/\/doi.org\/10.1002\/chem.201905812<\/a><\/p>\n<p>D. R. Silva, L. A. Zeoly, R. A. Cormanich, C. F. Guerra, M. P. Freitas &#8220;Evaluation of the Alicyclic Gauche Effect in 2\u2013Fluorocyclohexanone Analogs: a Combined NMR and DFT Study&#8221;, <em>European Journal of Organic Chemistry<\/em>\u00a0<strong>2020<\/strong>, 884-890. <a href=\"https:\/\/doi.org\/10.1002\/ejoc.201901815\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1002\/ejoc.201901815<\/a><\/p>\n<p>L. H. Sim\u00f5es, R. A. Cormanich &#8220;Stereoelectronic effects in multivicinal fluoroalkanes and conformational implications&#8221;, <em>European Journal of Organic Chemistry<\/em>\u00a0<strong>2020<\/strong>, 501-505. <a href=\"https:\/\/doi.org\/10.1002\/ejoc.201901780\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1002\/ejoc.201901780<\/a><\/p>\n<h3><strong>2019<\/strong><\/h3>\n<p>L. A. Zeoly, F. Coelho, R. A. Cormanich &#8220;An Intramolecular H-Bond Is Formed in 2-Fluorophenol and 2-Fluorothiophenol, but It May Not Be the Main Pathway of The <em>J<\/em>FH Coupling Constant Transmission&#8221;,\u00a0<em>Journal of Physical Chemistry A <\/em><strong>2019<\/strong><em>, 123, <\/em>10072-10078.<a href=\"https:\/\/doi.org\/10.1021\/acs.jpca.9b07970\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1021\/acs.jpca.9b07970<\/a><\/p>\n<p>A. A. G. Fernandes, A. F. da Silva, C. Y. Okada Jr., V. Suzukawa, R. A. Cormanich, I. D. Jurberg &#8220;General Platform for the Conversion of Isoxazol-5-ones to 3,5-Disubstituted Isoxazoles via Nucleophilic Substitutions and Palladium Catalyzed Cross-Coupling Strategies&#8221;, <em>European Journal of Organic Chemistry<\/em> <strong>2019<\/strong>, 3022-3034. <a href=\"https:\/\/doi.org\/10.1002\/ejoc.201900187\" target=\"_blank\" rel=\"noopener noreferrer\"> https:\/\/doi.org\/10.1002\/ejoc.201900187<\/a><\/p>\n<p>L. A. F. Andrade, L. A. Zeoly, R. A. Cormanich, M. P. Freitas &#8220;Conformational signature of Ishikawa\u00b4 s reagent using NMR information from diastereotopic fluorines&#8221;,\u00a0<em>Beilstein Journal of Organic Chemistry<\/em>\u00a0<strong>2019<\/strong>, <em>15<\/em>, 506-512. <a href=\"https:\/\/doi.org\/10.3762\/bjoc.15.44\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.3762\/bjoc.15.44<\/a><\/p>\n<h3><strong>2018<\/strong><\/h3>\n<p>F. A. Martins, L. A. Zeoly, R. A. Cormanich, M. P. Freitas &#8220;Solution conformations for the flexible 1-chloro-1, 1-difluoro-2-pentanol unveiled using multinuclear magnetic resonance&#8221;,\u00a0<em>Tetrahedron <\/em><strong>2018<\/strong><em>,<\/em> <em>74<\/em>, 880-883. <a href=\"https:\/\/doi.org\/10.1002\/ejoc.201800528\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1002\/ejoc.201800528<\/a><\/p>\n<p>F. de Souza Fernandes, R. A. Cormanich, L. A. Zeoly, A. L. B. Formiga, F. Coelho&#8221;Employing Small Polyfunctionalized Molecules for a Diastereoselective Synthesis of Highly Substituted Indolines&#8221;,\u00a0<em>European Journal of Organic Chemistry<\/em>\u00a0<strong>2018<\/strong>, <em>24<\/em>, 3211-3223. <a href=\"https:\/\/doi.org\/10.1002\/ejoc.201800528\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1002\/ejoc.201800528<\/a><\/p>\n<p><a class=\"gsc_a_at\" data-href=\"\/citations?view_op=view_citation&amp;hl=pt-BR&amp;user=B0lO77EAAAAJ&amp;sortby=pubdate&amp;citation_for_view=B0lO77EAAAAJ:GnPB-g6toBAC\"><span style=\"color: #000000;\">L. Ahmed, Y. Zhang, E. Block, M. Buehl, M. J. Corr, Rodrigo A. Cormanich, S. Gundala, H. Matsunami, D. O\u2019Hagan, M. Ozbil, Y. Pan, S. Sekharan, N. Ten, M. Wang, M. Yang, Q. Zhang, R. Zhang, V. S. Batista, H. Zhuang &#8220;Molecular mechanism of activation of human musk receptors OR5AN1 and OR1A1 by (R)-muscone and diverse other musk-smelling compounds&#8221;,\u00a0<em>Proceedings of the National Academy of Sciences <\/em><strong>2018,<\/strong> 115, E3950-E3958.<\/span>\u00a0\u00a0<\/a><a href=\"https:\/\/doi.org\/10.1073\/pnas.171302611\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1073\/pnas.171302611<\/a><\/p>\n<p><span style=\"color: #000000;\">J. G. P. Mendon\u00e7a, S. A. Fernandes, R. A. Cormanich, M. P. Freitas &#8220;<\/span><a class=\"gsc_a_at\" data-href=\"\/citations?view_op=view_citation&amp;hl=pt-BR&amp;user=B0lO77EAAAAJ&amp;sortby=pubdate&amp;citation_for_view=B0lO77EAAAAJ:O3NaXMp0MMsC\"><span style=\"color: #000000;\">Anion effect on the conformational equilibrium of sulfamide and its\u00a0<i>N,N\u2032<\/i>\u2010diindolyl derivative: Insights on anion transportation&#8221;,\u00a0<em>Journal of Physical Organic Chemistry<\/em>\u00a0<strong>2018<\/strong>, e3850.<\/span>\u00a0\u00a0<\/a><a href=\"https:\/\/doi.org\/10.1002\/poc.3850\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1002\/poc.3850<\/a><\/p>\n<h3><strong>2017<\/strong><\/h3>\n<p>R. A. Cormanich, D. O&#8217;Hagan, M. B\u00fchl &#8220;Hyperconjugation Is the Source of Helicity in Perfluorinated n\u2010Alkanes&#8221;,\u00a0 <em>Angewandte Chemie<\/em>\u00a0<strong>2017<\/strong>, <em>129<\/em> (27), 7975-7978.\u00a0<a href=\"https:\/\/doi.org\/10.1002\/ange.201704112\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1002\/ange.201704112<\/a><\/p>\n<p>L. A. F. Andrade, J. M. Silla, R. A. Cormanich, M. P. Freitas &#8220;Infrared Fingerprints of nN \u2192 \u03c3*NH Hyperconjugation in Hydrazides&#8221;, <em>The Journal of organic chemistry<\/em>\u00a0<strong>2017<\/strong>, <em>82<\/em> (23), 12181-12187.\u00a0<a href=\"https:\/\/doi.org\/10.1021\/acs.joc.7b01985\" target=\"_blank\" rel=\"noopener noreferrer\">https:\/\/doi.org\/10.1021\/acs.joc.7b01985<\/a><\/p>\n\n\n<p class=\"wp-block-paragraph\"><\/p>\n\n\n\n<p class=\"wp-block-paragraph\"><\/p>\n","protected":false},"excerpt":{"rendered":"<p>2026 J. Stewart; B. A Piscelli; D. B. Cordes; R. A. Cormanich; D. O&#8217;Hagan &#8220;Incorporation and properties of the tris-fluoromethylated motif into heterocycles, amino acids and analogues of elexacaftor and tezacaftor&#8221; Chemical Science, 2026. https:\/\/doi.org\/10.1039\/D6SC04239B B. A. Piscelli, C. E. V. P. Nascimento, R. A. Cormanich &#8220;How Fluorination Collapses Inversion Barriers and Increases Electrophilicity in&#8230;<\/p>\n","protected":false},"author":1,"featured_media":0,"parent":0,"menu_order":0,"comment_status":"closed","ping_status":"closed","template":"","meta":{"footnotes":""},"class_list":["post-71","page","type-page","status-publish","hentry"],"_links":{"self":[{"href":"https:\/\/cormanich.iqm.unicamp.br\/index.php?rest_route=\/wp\/v2\/pages\/71","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/cormanich.iqm.unicamp.br\/index.php?rest_route=\/wp\/v2\/pages"}],"about":[{"href":"https:\/\/cormanich.iqm.unicamp.br\/index.php?rest_route=\/wp\/v2\/types\/page"}],"author":[{"embeddable":true,"href":"https:\/\/cormanich.iqm.unicamp.br\/index.php?rest_route=\/wp\/v2\/users\/1"}],"replies":[{"embeddable":true,"href":"https:\/\/cormanich.iqm.unicamp.br\/index.php?rest_route=%2Fwp%2Fv2%2Fcomments&post=71"}],"version-history":[{"count":45,"href":"https:\/\/cormanich.iqm.unicamp.br\/index.php?rest_route=\/wp\/v2\/pages\/71\/revisions"}],"predecessor-version":[{"id":1676,"href":"https:\/\/cormanich.iqm.unicamp.br\/index.php?rest_route=\/wp\/v2\/pages\/71\/revisions\/1676"}],"wp:attachment":[{"href":"https:\/\/cormanich.iqm.unicamp.br\/index.php?rest_route=%2Fwp%2Fv2%2Fmedia&parent=71"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}