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Information card for entry 7125436
Preview
| Coordinates | 7125436.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H29 B F3 N7 O5 S W |
|---|---|
| Calculated formula | C25 H29 B F3 N7 O5 S W |
| Title of publication | Synthesis of pyridyl carbyne complexes and their conversion to N-heterocyclic vinylidenes |
| Authors of publication | Hill, Anthony; Frogley, Benjamin |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 33.2746 ± 0.0005 Å |
| b | 13.8436 ± 0.0002 Å |
| c | 14.0874 ± 0.0002 Å |
| α | 90° |
| β | 98.529 ± 0.001° |
| γ | 90° |
| Cell volume | 6417.46 ± 0.16 Å3 |
| Cell temperature | 150 ± 0.1 K |
| Ambient diffraction temperature | 150 ± 0.1 K |
| Number of distinct elements | 8 |
| 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 | 0.0301 |
| Residual factor for significantly intense reflections | 0.025 |
| Weighted residual factors for significantly intense reflections | 0.059 |
| Weighted residual factors for all reflections included in the refinement | 0.0613 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.016 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 243756 (current) | 2019-11-27 | cif/ Adding structures of 7125433, 7125434, 7125435, 7125436, 7125437, 7125438, 7125439 via cif-deposit CGI script. |
7125436.cif |
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Users of the data should acknowledge the original authors of the
structural data.