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| Supporting Information File 1: 1H and 13C NMR spectra at 25 and −80 °C, supplementary theoretical values, RScript for PCA and the Cartesian coordinates of the structures. | ||
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| Supporting Information File 2: NBO data for PCA. | ||
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Cite the Following Article
Strong hyperconjugative interactions limit solvent and substituent influence on conformational equilibrium: the case of cis-2-halocyclohexylamines
Camila B. Francisco, Cleverton S. Fernandes, Ulisses Z. de Melo, Roberto Rittner, Gisele F. Gauze and Ernani A. Basso
Beilstein J. Org. Chem. 2019, 15, 818–829.
https://doi.org/10.3762/bjoc.15.79
How to Cite
Francisco, C. B.; Fernandes, C. S.; de Melo, U. Z.; Rittner, R.; Gauze, G. F.; Basso, E. A. Beilstein J. Org. Chem. 2019, 15, 818–829. doi:10.3762/bjoc.15.79
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- Li, X.; Wang, J.; Wang, T.; Wang, N.; Zong, S.; Huang, X.; Hao, H. Molecular mechanism of crystal nucleation from solution. Science China Chemistry 2021, 64, 1460–1481. doi:10.1007/s11426-021-1015-9
- Melo, U. Z.; Fernandes, C. S.; Francisco, C. B.; Carini, T. C.; Gauze, G. F.; Rittner, R.; Basso, E. A. Conformational Isomerism of 3-Chalcogenomethyl-N-Methyl-2-Pyrrolidinones: Insights from NMR Spectroscopy and Molecular Modeling. The journal of physical chemistry. A 2020, 124, 8509–8518. doi:10.1021/acs.jpca.0c06679
- Muchowska, K. B.; Pascoe, D. J.; Borsley, S.; Smolyar, I. V.; Mati, I. K.; Adam, C.; Nichol, G. S.; Ling, K. B.; Cockroft, S. L. Reconciling Electrostatic and n→π* Orbital Contributions in Carbonyl Interactions. Angewandte Chemie 2020, 132, 14710–14716. doi:10.1002/ange.202005739
- Muchowska, K. B.; Pascoe, D. J.; Borsley, S.; Smolyar, I. V.; Mati, I. K.; Adam, C.; Nichol, G. S.; Ling, K.; Cockroft, S. L. Reconciling Electrostatic and n→π* Orbital Contributions in Carbonyl Interactions. Angewandte Chemie (International ed. in English) 2020, 59, 14602–14608. doi:10.1002/anie.202005739
