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Information card for entry 8104626
Preview
| Coordinates | 8104626.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C14 H11 Cl N2 O3 |
|---|---|
| Calculated formula | C14 H11 Cl N2 O3 |
| SMILES | c1(c(cccc1)O)C(=O)N/N=C/c1c(cccc1Cl)O |
| Title of publication | Crystal structure of (E)-N′-(2-chloro-6-hydroxybenzylidene)-2-hydroxybenzohydrazide, C14H11ClN2O3 |
| Authors of publication | Liu, Jianlian; Hao, Hong; Du, Chaojun |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2021 |
| Journal volume | 236 |
| Journal issue | 5 |
| Pages of publication | 929 - 930 |
| a | 7.0242 ± 0.0011 Å |
| b | 25.375 ± 0.004 Å |
| c | 7.6789 ± 0.0013 Å |
| α | 90° |
| β | 111.275 ± 0.002° |
| γ | 90° |
| Cell volume | 1275.4 ± 0.4 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 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 | 0.0433 |
| Residual factor for significantly intense reflections | 0.0349 |
| Weighted residual factors for significantly intense reflections | 0.1072 |
| Weighted residual factors for all reflections included in the refinement | 0.1123 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.01 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 273327 (current) | 2022-03-04 | cif/ Adding structures of 8104626 via cif-deposit CGI script. |
8104626.cif |
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Users of the data should acknowledge the original authors of the
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