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Information card for entry 7156870
Preview
Coordinates | 7156870.cif |
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Original paper (by DOI) | HTML |
Formula | C31 H30 N O3 P |
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Calculated formula | C31 H30 N O3 P |
Title of publication | Ene reactions of 2-borylated α-methylstyrenes: a practical route to 4-methylenechromanes and derivatives. |
Authors of publication | Boureghda, Chaima; Macé, Aurélie; Berrée, Fabienne; Roisnel, Thierry; Debache, Abdelmadjid; Carboni, Bertrand |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2019 |
Journal volume | 17 |
Journal issue | 23 |
Pages of publication | 5789 - 5800 |
a | 9.164 ± 0.0012 Å |
b | 10.0512 ± 0.0013 Å |
c | 28.621 ± 0.004 Å |
α | 90° |
β | 90.278 ± 0.005° |
γ | 90° |
Cell volume | 2636.2 ± 0.6 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 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 | 0.1164 |
Residual factor for significantly intense reflections | 0.1019 |
Weighted residual factors for significantly intense reflections | 0.2171 |
Weighted residual factors for all reflections included in the refinement | 0.2239 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.172 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
225253 (current) | 2019-11-08 | cif/ Updating files of 7156870 Original log message: Adding full bibliography for 7156870.cif. |
7156870.cif |
215298 | 2019-05-18 | cif/ Adding structures of 7156870 via cif-deposit CGI script. |
7156870.cif |
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Users of the data should acknowledge the original authors of the
structural data.