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Information card for entry 7717295
Preview
| Coordinates | 7717295.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | (CAAC)BDur(NCS) |
|---|---|
| Chemical name | 2b |
| Formula | C31 H44 Be N2 S |
| Calculated formula | C31 H44 Be N2 S |
| Title of publication | Synthesis and structures of molecular beryllium Grignard analogues featuring terminal and bridging pseudohalides. |
| Authors of publication | Czernetzki, Corinna; Arrowsmith, Merle; Jürgensen, Malte; Hagspiel, Stephan; Braunschweig, Holger |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2024 |
| Journal volume | 53 |
| Journal issue | 45 |
| Pages of publication | 18296 - 18303 |
| a | 10.4324 ± 0.0005 Å |
| b | 18.541 ± 0.005 Å |
| c | 15.2352 ± 0.0007 Å |
| α | 90° |
| β | 93.294 ± 0.006° |
| γ | 90° |
| Cell volume | 2942 ± 0.8 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 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 | 0.0443 |
| Residual factor for significantly intense reflections | 0.0411 |
| Weighted residual factors for significantly intense reflections | 0.1168 |
| Weighted residual factors for all reflections included in the refinement | 0.1196 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.067 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Diffraction radiation X-ray symbol | K-L~2,3~ |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 296603 (current) | 2024-12-06 | cif/ Updating files of 7717294, 7717295, 7717296, 7717297, 7717298, 7717299, 7717300, 7717301 Original log message: Adding full bibliography for 7717294--7717301.cif. |
7717295.cif |
| 295645 | 2024-10-26 | cif/ Adding structures of 7717294, 7717295, 7717296, 7717297, 7717298, 7717299, 7717300, 7717301 via cif-deposit CGI script. |
7717295.cif |
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Users of the data should acknowledge the original authors of the
structural data.