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Information card for entry 7133037
Preview
Coordinates | 7133037.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C23 H28 F3 N O8 S |
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Calculated formula | C23 H28 F3 N O8 S |
Title of publication | Enantioselective <i>de novo</i> synthesis of 14-hydroxy-6-oxomorphinans. |
Authors of publication | Moore, Jonathan C.; Modell, Louis; Glenn, Jacqueline R.; Jones, Kieran D.; Argent, Stephen P.; Lane, J. Robert; Canals, Meritxell; Lam, Hon Wai |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2024 |
Journal volume | 60 |
Journal issue | 47 |
Pages of publication | 6007 - 6010 |
a | 12.4612 ± 0.0002 Å |
b | 10.5196 ± 0.0001 Å |
c | 20.4828 ± 0.0003 Å |
α | 90° |
β | 107.749 ± 0.002° |
γ | 90° |
Cell volume | 2557.22 ± 0.07 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 6 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0255 |
Residual factor for significantly intense reflections | 0.0247 |
Weighted residual factors for significantly intense reflections | 0.0643 |
Weighted residual factors for all reflections included in the refinement | 0.0649 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
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/7133037.html
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Users of the data should acknowledge the original authors of the
structural data.