Projetos Ativos
Publicações do projeto
| proj644 | Universidade Estadual de Campinas | Instituto de Quimica |
|---|---|---|
| Estudos Fisico Quimicos de Compostos Organicos fluorados: Abordagens Experimental e Teorica. | ||
| Publicações | Mestrado | Doutorado |
| 43 | 3 | 0 |
| Publicação Chemical Communications. |
Data, Vol/Fasc/Pag Issue 10, 2025. |
| Título Visible light-mediated formal alkylation and [4+1]-cycloaddition strategies of silyl enol ethers with aryldiazoacetates. | |
| Autores Guilherme Cariello et al. | |
| Publicação The Journal of Organic Chemistry. |
Data, Vol/Fasc/Pag November 27, 2024. |
| Título Synthesis of Janus All-Cis Tetrafluorocyclohexanes Carrying 1,4-Diether Motifs. | |
| Autores Thomas J. Poskin et al. | |
| Publicação Journal of Chemical Theory and Computation. |
Data, Vol/Fasc/Pag November 29, 2024. |
| Título On the Performance of Second-Order Polarization Propagator Methods in the Calculation of 1JFC and nJFH NMR Spin-Spin Coupling. | |
| Autores Marinella de Giovanetti, Rodrigo A. Cormanich, Stephan P. A. Sauer. | |
| Publicação The Journal of Organic Chemistry. |
Data, Vol/Fasc/Pag November 8, 2024. |
| Título Stereoselective Ring-Opening Reaction of a-Fluorinated Oxetanes:A Practical and Theoretical Investigation. | |
| Autores David Leparfait et al. | |
| Publicação The Journal of Organic Chemistry. |
Data, Vol/Fasc/Pag March 5, 2024. |
| Título Conformational Analysis Explores the Role of Electrostatic Nonclassical CF...HC Hydrogen Bonding Interactions in Selectively Halogenated Cyclohexanes. | |
| Autores Mengfan HeBruno A. PiscelliRodrigo A. Cormanich and David OHagan. | |
| Publicação Angewandte. |
Data, Vol/Fasc/Pag Volume64, Issue14, April 1, 2025. |
| Título Synthesis and Reactivity of Six-Membered Cyclic Diaryl y3-Bromanes and y3-Chloranes. | |
| Autores D. Bhattacherjee, B. M. Kariuki, B. A. Piscelli, R. A. Cormanich, T. Wirth. | |
| Publicação J. Chem. Inf. Model. |
Data, Vol/Fasc/Pag 2024, 64, 8, 3322-3331, |
| Título Autobench V1.0: Benchmarking Automation for Electronic Structure Calculations. | |
| Autores Rodrigo A. Cormanich and Gabriel D. da Silva. | |
| Publicação J. Org. Chem. |
Data, Vol/Fasc/Pag 2024, 89, 6, 4009-4018. |
| Título Conformational Analysis Explores the Role of Electrostatic Nonclassical CF---HC Hydrogen Bonding Interactions in Selectively Halogenated Cyclohexanes. | |
| Autores Mengfan He, Bruno A. Piscelli, Rodrigo A. Cormanich and David O Hagan. | |
| Publicação Chemical Communications. |
Data, Vol/Fasc/Pag Issue 99, 2023. |
| Título The pitfalls of using JHF spin-spin coupling constants to infer hydrogen bond formation in organofluorine compounds. | |
| Autores Guilherme Cariello, Lucas A. Zeoly, Bruno A. Piscelli, Thomas Lectka and Rodrigo A. Cormanich. | |
| Publicação Journal of Fluorine Chemistry. |
Data, Vol/Fasc/Pag Volume 272, November 2023, 110191. |
| Título The CF---HCF2 interaction:A combination of hydrogen bonding and n-o* stabilization. | |
| Autores Nathaniel G. Garrison et al. | |
| Publicação Org. Lett. |
Data, Vol/Fasc/Pag 2023, 25, 37, 6802-6807. |
| Título Aryl B B' B''-Trifluoro)-tert-butyl:A Candidate Motif for the Discovery of Bioactives. | |
| Autores Luca S. Dobson et al. | |
| Publicação J. Phys. Chem. A. |
Data, Vol/Fasc/Pag 2023, 127, 3, 724-728. |
| Título Contribution of Hyperconjugation and Inductive Effects to the Pseudo-anomeric Effect in 4-Substituted Methoxycyclohexanes, | |
| Autores Bruno A. Piscelli, David OHagan, and Rodrigo A. Cormanich. | |
| Publicação Chemical Communications. |
Data, Vol/Fasc/Pag Issue 57, 2022. |
| Título Janus faced fluorocyclohexanes for supramolecular assembly: synthesis and solid state structures of equatorial mono-, di- and tri alkylated ... | |
| Autores Thomas J. Poskin et al. | |
| Publicação ChemPlusChem. |
Data, Vol/Fasc/Pag 03 August 2022. |
| Título In Silico Interactions of the Components from the Schinus terebinthifolius Extract with Human Tyrosinase. | |
| Autores Julia N. Bezerra et al. | |
| Publicação Chemical Communications. |
Data, Vol/Fasc/Pag 2022, 58, 12855-12858. |
| Título Unexpected triaxial preferences in some all-syn1,3,5-trifluorocyclohexanes. | |
| Autores Cihang Yu et al. | |
| Publicação ACS Sustainable Chem. Eng. |
Data, Vol/Fasc/Pag 2022, 10, 48, 1587615888. |
| Título Direct Ethyl Levulinate Production from Raw Lignocellulosic Biomass Mediated by a Novel Taurine-Based Imidazolium Ionic Liquid. | |
| Autores Gustavo R. Gomes et al. | |
| Publicação J. Phys. Chem. A. |
Data, Vol/Fasc/Pag 2023, 127, 3, 724-728. |
| Título ontribution of Hyperconjugation and Inductive Effects to the Pseudo-anomeric Effect in 4-Substituted Methoxycyclohexanes. | |
| Autores Bruno A. Piscelli, David OHagan, and Rodrigo A. Cormanich. | |
| Publicação Organic and Biomolecular Chemistry. |
Data, Vol/Fasc/Pag Issue 17, 2023. |
| Título One-pot organocatalyzed synthesis of tricyclic indolizines. | |
| Autores Lucas A. Zeoly et al. | |
| Publicação Chemistry: A European Journal. |
Data, Vol/Fasc/Pag 2022, 28, e202103623. |
| Título Chiral Ligands in Hypervalent Iodine Compounds: Synthesis and Structures of Binaphthyl-Based 3-Iodanes. | |
| Autores H. Zhang, R. A. Cormanich, T. Wirth. | |
| Publicação Organic Chemistry Frontiers. |
Data, Vol/Fasc/Pag 2022, 9, 1321-1326. |
| Título A Visible Light-Mediated Three-Component Strategy Based on the Ring-Opening of Cyclic Ethers with Aryldiazoacetates and Nucleophiles. | |
| Autores M. L. Stivanin, R. D. C. Gallo, J. P. M. Spadeto, R. A. Cormanich, I. D. Jurberg. | |
| Publicação Journal of Chemical Theory and Computation. |
Data, Vol/Fasc/Pag 2021, 17, 7712-7723. |
| Título On the Unexpected Accuracy of the M06L Functional in the Calculation of 1JFC Spin-Spin Coupling Constants. | |
| Autores M. Giovannetti, L. F. F. Bitencourt, R. A. Cormanich, S. Sauer. | |
| Publicação Journal of Biomolecular Structure and Dynamics. |
Data, Vol/Fasc/Pag 2021. |
| Título Fluorinated dihydropyridines as candidates to block L-type voltage-dependent calcium channels. | |
| Autores J. P. M. Spadeto, M. P. Freitas, R. A. Cormanich. | |
| Publicação Physical Chemistry Chemical Physics. |
Data, Vol/Fasc/Pag 2021, 23, 17329-17337. |
| Título There and back again: the role of hyperconjugation in the fluorine gauche effect. | |
| Autores Vinicius C. Port, Rodrigo A. Cormanich. | |
| Publicação Chemical Science. |
Data, Vol/Fasc/Pag 2021, 12, 9712-9719. |
| Título Supramolecular packing of alkyl substituted Janus face all-cis 2,3,4,5,6-pentafluorocyclohexyl motifs. | |
| Autores J. Clark et al. | |
| Publicação Journal of Biomolecular Structure and Dynamics. |
Data, Vol/Fasc/Pag 2021. |
| Título Docking and mol. dynam. studies potential new leads against DBL3x derived from chondroitin sulfate A(CSA):a new approach for the treatment of malaria. | |
| Autores J. P. M. Spadeto, R. A. Cormanich, T. C. C. Franca, S. R. LaPlante, A. S. Goncalves. | |
| Publicação Physical Chemistry Chemical Physics. |
Data, Vol/Fasc/Pag 2021, 23, 5845-5851. |
| Título The contribution of non-classical CHax...OC hydrogen bonds to the anomeric effect in fluoro and oxa-methoxycyclohexanes. | |
| Autores B. A. Piscelli, D. O Hagan, R. A. Cormanich. | |
| Publicação Physical Chemistry Chemical Physics. |
Data, Vol/Fasc/Pag 2021, 23, 9080-9088. |
| Título Through Space JHF Spin-Spin Coupling Cons Transm Path in 2-(Trifluoromethyl)thiophenol: form of unusual stabilizing bifurcated CFHS and CFSH interac. | |
| Autores V. C. Port, L. A. Zeoly, F. Coelho, R. A Cormanich. | |
| Publicação Journal of Mass Spectrometry. |
Data, Vol/Fasc/Pag 2021, 56, e4707. |
| Título Unveiling the mechanism of N-methylation of indole with dimethylcarbonate using either DABCO or DBU as catalyst. | |
| Autores P. H. Vendramini, L. A. Zeoly, R. A. Cormanich, M. Buehl, M. N. Eberlin, B. R. V. Ferreira. | |
| Publicação International Journal of Quantum Chemistry. |
Data, Vol/Fasc/Pag 2021, 121, e26785. |
| Título Challenges in studying steric interactions in highly strained perhalogenated alkanes and silanes. | |
| Autores Luis H. Simoes, Rodrigo A. Cormanich. | |
| Publicação EurJOC. |
Data, Vol/Fasc/Pag 17 December 2019. |
| Título Stereoelectronic Effects in Multivicinal Fluoroalkanes and Conformational Implications. | |
| Autores Luis H Simoes, Rodrigo Cormanich. | |
| Publicação EurJOC. |
Data, Vol/Fasc/Pag 14 January 2020. |
| Título Evaluation of the Alicyclic Gauche Effect in 2-Fluorocyclohexanone Analogs: a Combined NMR and DFT Study. | |
| Autores Daniela R Silva, Lucas A. Zeoly, Rodrigo A. Cormanich, Celia Fonseca Guerra, Matheus P. Freitas. | |
| Publicação Chemistry Europe. |
Data, Vol/Fasc/Pag 30 January 2020. |
| Título Room Temperature Coupling of Aryldiazoacetates with Boronic Acids Enhanced by Blue Light Irradiation. | |
| Autores Amanda F. da Silva, Marco A. S. Afonso, Rodrigo A. Cormanich, Igor D. Jurberg. | |
| Publicação Chemistry Europe. |
Data, Vol/Fasc/Pag 26 June 2020. |
| Título Fluorine-Induced Pseudo-Anomeric Effects in Methoxycyclohexanes through Electrostatic 1,3-Diaxial Interaction. | |
| Autores Bruno A. Piscelli et al. | |
| Publicação J. Org. Chem. |
Data, Vol/Fasc/Pag 2020, 85, 17, 11541-11548. |
| Título Origin of the Diastereoselectivity of the Heterogeneous Hydrogenation of a Substituted Indolizine. | |
| Autores Rodrigo A. Cormanich, Lucas A. Zeoly, Hugo Santos, Nilton S. Camilo, Michael Buhl, Fernando Coelho. | |
| Publicação Physical Chemistry Chemical Physics. |
Data, Vol/Fasc/Pag Issue 46, 2020. |
| Título The preferred geometry of hydroperoxides is the result of an interplay between electrostatic and hyperconjugative effects. | |
| Autores Marco A. S. Afonso and Rodrigo A. Cormanich. | |
| Publicação Physical Chemistry Chemical Physics. |
Data, Vol/Fasc/Pag Issue 10, 2021. |
| Título The contribution of non-classical CHax---OC hydrogen bonds to the anomeric effect in fluoro and oxa-methoxycyclohexanes. | |
| Autores Bruno A. Piscelli, David O Hagan and Rodrigo A. Cormanich. | |
| Publicação Journal of Biomolecular Structure and Dynamics. |
Data, Vol/Fasc/Pag 16 Apr 2021. |
| Título Docking and mol. dyn. studies of pot. new leads against DBL3x derived from chondroitin sulfate A (CSA):a new approach for the treatment of malaria. | |
| Autores Joao P. M. Spadeto, Rodrigo A. Cormanich, Tanos C.C. Franca, Steven R. LaPlante, Arlan S. Goncalves. | |
| Publicação Chemical Science. |
Data, Vol/Fasc/Pag 04 Jun 2021. |
| Título Supramolecular packing of alkyl substituted Janus face all-cis 2,3,4,5,6-pentafluorocyclohexyl motifs. | |
| Autores Joshua L. Clark et al. | |
| Publicação Physical Chemistry Chemical Physics. |
Data, Vol/Fasc/Pag Issue 15, 2021. |
| Título Through space JFH spin-spin coupling constant transm. pathways in 2-(trifluoromethyl) thiophenol:form. of unusual stab. bif. CF---HS and CF---SH int. | |
| Autores Vinicius C. Port, Lucas A. Zeoly, Fernando Coelho and Rodrigo A. Cormanic. | |
| Publicação European Journal of Organic Chemistry |
Data, Vol/Fasc/Pag 2018 / V. 2018, Issue24 Pages 3211-3223 |
| Título Employing Small Polyfunctionalized Molecules for a Diastereoselective Synthesis of Highly Substituted Indolines | |
| Autores Fábio de S. Fernandes Rodrigo A. Cormanich, Lucas A. Zeoly, André L. B. Formiga e Fernando Coelho | |
| Publicação european journal of organic chemistry. |
Data, Vol/Fasc/Pag Vol 2018 Ed 24 - June 29, 2018. |
| Título Employing Small Polyfunctionalized Molecules for a Diastereoselective Synthesis of Highly Substituted Indolines. | |
| Autores Fábio de Souza Fernandes Rodrigo A. Cormanich Lucas A. Zeoly André Luiz B. Formiga Fernando Coelho. | |
| Publicação TETRAHEDRON. |
Data, Vol/Fasc/Pag Vol 74 Ed 8 Pg 880-883 - 22/02/2018 |
| Título Solution conformations for the flexible 1-chloro-1,1-difluoro-2-pentanol unveiled using multinuclear magnetic resonance. | |
| Autores Martins, Francisco A.; Zeoly, Lucas A.; Cormanich, Rodrigo A.; et al. | |
| Publicação Angew Chem Int Ed Engl. |
Data, Vol/Fasc/Pag 2017 May 31. |
| Título Hyperconjugation Is the Source of Helicity in Perfluorinated n-Alkanes. | |
| Autores Cormanich, R.A.; O Hagan, D; Buhl, M. | |