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Collect. Czech. Chem. Commun. 1997, 62, 1384-1395
https://doi.org/10.1135/cccc19971384

Measurement and Calculation of the Raman Optical Activity of α-Pinene and trans-Pinane

Petr Bouřa, Vladimír Baumrukb and Jana Hanzlíkováb

a Institute of Organic Chemistry and Biochemistry, Academy of Sciences of the Czech Republic,166 10 Prague 6, Czech Republic
b Institute of Physics, Charles University, 121 16 Prague 2, Czech Republic

Crossref Cited-by Linking

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  • Chruszcz-Lipska Katarzyna: Probing the stereochemical structure of carenes using Raman and Raman optical activity spectroscopy. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 2022, 276, 121176. <https://doi.org/10.1016/j.saa.2022.121176>
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  • Mattiat Johann, Luber Sandra: Vibrational (resonance) Raman optical activity with real time time dependent density functional theory. The Journal of Chemical Physics 2019, 151. <https://doi.org/10.1063/1.5132294>
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  • Luber Sandra: Raman Optical Activity Spectra from Density Functional Perturbation Theory and Density-Functional-Theory-Based Molecular Dynamics. J. Chem. Theory Comput. 2017, 13, 1254. <https://doi.org/10.1021/acs.jctc.6b00820>
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  • Parchaňský Václav, Kapitán Josef, Bouř Petr: Inspecting chiral molecules by Raman optical activity spectroscopy. RSC Adv. 2014, 4, 57125. <https://doi.org/10.1039/C4RA10416A>
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  • Baranska Malgorzata, Chruszcz-Lipska Katarzyna: Raman Optical Activity: A Powerful Technique to Investigate Essential Oil Components. Natural Product Communications 2010, 5, 1934578X1000500. <https://doi.org/10.1177/1934578X1000500914>
  • Ruud Kenneth, Thorvaldsen Andreas J.: Theoretical approaches to the calculation of Raman optical activity spectra. Chirality 2009, 21. <https://doi.org/10.1002/chir.20777>
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  • Bouř Petr: Computations of the Raman optical activity via the sum-over-states expansions. J Comput Chem 2001, 22, 426. <https://doi.org/10.1002/1096-987X(200103)22:4<426::AID-JCC1013>3.0.CO;2-#>
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  • Hanzlı́ková Jana, Praus Petr, Baumruk Vladimı́r: Raman optical activity spectrometer for peptide studies. Journal of Molecular Structure 1999, 480-481, 431. <https://doi.org/10.1016/S0022-2860(98)00718-2>
  • Bouř P., Buděšı́nský M.: Sum-over-states calculation of the nuclear spin–spin coupling constants. The Journal of Chemical Physics 1999, 110, 2836. <https://doi.org/10.1063/1.477925>
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  • Bouř P., McCann J., Wieser H.: The excitation scheme: A new method for calculation of vibrational circular dichroism spectra. The Journal of Chemical Physics 1998, 108, 8782. <https://doi.org/10.1063/1.476324>
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