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Information card for entry 8104939
Preview
| Coordinates | 8104939.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C14 H16 N4 O3 |
|---|---|
| Calculated formula | C14 H16 N4 O3 |
| Title of publication | The crystal structure of 4-amino-N′-(4-aminobenzoyl)benzohydrazide monohydrate, C14H16N4O3 |
| Authors of publication | Xi-Shi, Tai; Xiao-Jing, Zhou; Li-Li, Liu; Ai-Ling, Zhang; Li-Hua, Wang |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2021 |
| Journal volume | 236 |
| Journal issue | 1 |
| Pages of publication | 259 - 260 |
| a | 8.0968 ± 0.0007 Å |
| b | 16.6829 ± 0.0017 Å |
| c | 5.3097 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 717.22 ± 0.12 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 18 |
| Hermann-Mauguin space group symbol | P 21 21 2 |
| Hall space group symbol | P 2 2ab |
| Residual factor for all reflections | 0.0548 |
| Residual factor for significantly intense reflections | 0.042 |
| Weighted residual factors for significantly intense reflections | 0.0759 |
| Weighted residual factors for all reflections included in the refinement | 0.0816 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.011 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 274102 (current) | 2022-03-30 | cif/ Adding structures of 8104939 via cif-deposit CGI script. |
8104939.cif |
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Users of the data should acknowledge the original authors of the
structural data.