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Information card for entry 8104979
Preview
| Coordinates | 8104979.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C13 H12 Cl N3 |
|---|---|
| Calculated formula | C13 H12 Cl N3 |
| Title of publication | The crystal structure of (E)-3-chloro-2-(2-(4-methylbenzylidene)hydrazinyl)pyridine, C13H12ClN3 |
| Authors of publication | Sun, Guo-Xiang; Min, Li-Jing; Han, Liang; Liu, Xing-Hai |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2022 |
| Journal volume | 237 |
| Journal issue | 1 |
| Pages of publication | 129 - 131 |
| a | 28.776 ± 0.0011 Å |
| b | 41.7393 ± 0.0017 Å |
| c | 8.5929 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 10320.8 ± 0.7 Å3 |
| Cell temperature | 296.15 K |
| Ambient diffraction temperature | 296.15 K |
| Number of distinct elements | 4 |
| Space group number | 43 |
| Hermann-Mauguin space group symbol | F d d 2 |
| Hall space group symbol | F 2 -2d |
| Residual factor for all reflections | 0.1144 |
| Residual factor for significantly intense reflections | 0.0477 |
| Weighted residual factors for significantly intense reflections | 0.0822 |
| Weighted residual factors for all reflections included in the refinement | 0.0976 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.934 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 274173 (current) | 2022-03-31 | cif/ Adding structures of 8104979 via cif-deposit CGI script. |
8104979.cif |
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Users of the data should acknowledge the original authors of the
structural data.