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Information card for entry 7246957
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Coordinates | 7246957.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C21 H18 O2 |
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Calculated formula | C21 H18 O2 |
Title of publication | A phosphine free, inorganic base free, one-pot tandem Mizoroki–Heck olefination/direct arylation/hydrogenation sequence, to give multicyclic alkylated heteroarenes |
Authors of publication | Kehoe, Roberta A.; Light, Mark E.; Jones, David J.; McGlacken, Gerard P. |
Journal of publication | Green Chemistry |
Year of publication | 2023 |
Journal volume | 25 |
Journal issue | 14 |
Pages of publication | 5654 - 5660 |
a | 7.6458 ± 0.0002 Å |
b | 6.1433 ± 0.0001 Å |
c | 66.279 ± 0.002 Å |
α | 90° |
β | 91.529 ± 0.002° |
γ | 90° |
Cell volume | 3112.05 ± 0.13 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 3 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.1323 |
Residual factor for significantly intense reflections | 0.1298 |
Weighted residual factors for significantly intense reflections | 0.348 |
Weighted residual factors for all reflections included in the refinement | 0.3493 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.09 |
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/7246957.html
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