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Information card for entry 7133414
Preview
Coordinates | 7133414.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C21 H15 Br O |
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Calculated formula | C21 H15 Br O |
Title of publication | Catalytic asymmetric construction of bridged bicyclo[<i>m</i>.3.1] rings using an intramolecular Diels-Alder reaction. |
Authors of publication | Li, Kai; Zhao, Zhengxing; Qin, Wenling; Liu, Yidong; Yan, Hailong |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2024 |
Journal volume | 60 |
Journal issue | 71 |
Pages of publication | 9570 - 9573 |
a | 15.1076 ± 0.0005 Å |
b | 10.0376 ± 0.0005 Å |
c | 20.6682 ± 0.001 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3134.2 ± 0.2 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0757 |
Residual factor for significantly intense reflections | 0.0391 |
Weighted residual factors for significantly intense reflections | 0.0763 |
Weighted residual factors for all reflections included in the refinement | 0.0899 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7133414.html
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