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Information card for entry 7048417
Preview
| Coordinates | 7048417.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C14 H8 Br2 |
|---|---|
| Calculated formula | C14 H8 Br2 |
| Title of publication | Simultaneous expansion of 9,10 boron-doped anthracene in longitudinal and lateral directions. |
| Authors of publication | John, Alexandra; Kirschner, Sven; Fengel, Melina K.; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2019 |
| Journal volume | 48 |
| Journal issue | 5 |
| Pages of publication | 1871 - 1877 |
| a | 18.001 ± 0.002 Å |
| b | 9.0764 ± 0.0006 Å |
| c | 7.2612 ± 0.0009 Å |
| α | 90° |
| β | 112.754 ± 0.009° |
| γ | 90° |
| Cell volume | 1094 ± 0.2 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0385 |
| Residual factor for significantly intense reflections | 0.0333 |
| Weighted residual factors for significantly intense reflections | 0.08 |
| Weighted residual factors for all reflections included in the refinement | 0.0827 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.065 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 265213 (current) | 2021-05-14 | cif/7/04/84/ Removed the '_chemical_name_systematic' data item that had clearly incorrect values from entries 7048415-7048417, 7048419, 7048421, 7048424. |
7048417.cif |
| 224012 | 2019-11-07 | cif/ Updating files of 7048415, 7048416, 7048417, 7048418, 7048419, 7048420, 7048421, 7048422, 7048423, 7048424, 7048425, 7048426, 7048427, 7048428 Original log message: Adding full bibliography for 7048415--7048428.cif. |
7048417.cif |
| 212705 | 2018-12-21 | cif/ Adding structures of 7048415, 7048416, 7048417, 7048418, 7048419, 7048420, 7048421, 7048422, 7048423, 7048424, 7048425, 7048426, 7048427, 7048428 via cif-deposit CGI script. |
7048417.cif |
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Users of the data should acknowledge the original authors of the
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