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Information card for entry 7702024
Preview
| Coordinates | 7702024.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C28.5 H21 B Cl F15 N O |
|---|---|
| Calculated formula | C28.5 H21 B Cl F15 N O |
| Title of publication | B(C6F5)3 mediated arene hydrogenation/transannulation of para-methoxyanilines. |
| Authors of publication | Longobardi, Lauren E.; Mahdi, Tayseer; Stephan, Douglas W. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2015 |
| Journal volume | 44 |
| Journal issue | 16 |
| Pages of publication | 7114 - 7117 |
| a | 17.75 ± 0.005 Å |
| b | 16.032 ± 0.004 Å |
| c | 20.783 ± 0.006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 5914 ± 3 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 149.7 K |
| Number of distinct elements | 7 |
| Space group number | 60 |
| Hermann-Mauguin space group symbol | P b c n |
| Hall space group symbol | -P 2n 2ab |
| Residual factor for all reflections | 0.1134 |
| Residual factor for significantly intense reflections | 0.0811 |
| Weighted residual factors for significantly intense reflections | 0.23 |
| Weighted residual factors for all reflections included in the refinement | 0.2505 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0628 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 233431 (current) | 2019-11-23 | cif/ Adding structures of 7702023, 7702024, 7702025, 7702026, 7702027 via cif-deposit CGI script. |
7702024.cif |
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Users of the data should acknowledge the original authors of the
structural data.