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Information card for entry 7158358
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Coordinates | 7158358.cif |
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Original paper (by DOI) | HTML |
Formula | C22 H25 Cl2 N O6 |
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Calculated formula | C22 H25 Cl2 N O6 |
Title of publication | Regio- and stereoselective (3 + 2)-cycloaddition reactions of nitrones with cyclic allenes. |
Authors of publication | Efremova, Mariia M.; Makarova, Anastasia A.; Novikov, Alexander S.; Kryukova, Mariya A.; Kuznetsov, Mikhail A.; Molchanov, Alexander P. |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2021 |
Journal volume | 19 |
Journal issue | 44 |
Pages of publication | 9773 - 9784 |
a | 8.9201 ± 0.0003 Å |
b | 27.3837 ± 0.0009 Å |
c | 9.5899 ± 0.0003 Å |
α | 90° |
β | 109.369 ± 0.004° |
γ | 90° |
Cell volume | 2209.9 ± 0.14 Å3 |
Cell temperature | 100 ± 0.11 K |
Ambient diffraction temperature | 100 ± 0.11 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0341 |
Residual factor for significantly intense reflections | 0.0314 |
Weighted residual factors for significantly intense reflections | 0.0827 |
Weighted residual factors for all reflections included in the refinement | 0.0845 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.064 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7158358.html
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structural data.