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Information card for entry 8106656
Preview
| Coordinates | 8106656.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C9 H13 Ag N4 O4 |
|---|---|
| Calculated formula | C9 H13 Ag N4 O4 |
| SMILES | [Ag]([n]1cnn(c2ccc(C(=O)[O-])cc2)c1)[NH3].O.O |
| Title of publication | The crystal structure of amine-(4-(1H-1,2,4-triazol-1-yl)benzoato-κN)silver(I) dihydrate, C9H13AgN4O4 |
| Authors of publication | Jin, Jun-Cheng; Fu, Ai-Yun; Sun, Chuan-Bo; Zhang, Yue-Hua |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2017 |
| Journal volume | 232 |
| Journal issue | 5 |
| Pages of publication | 725 - 726 |
| a | 28.123 ± 0.003 Å |
| b | 7.0409 ± 0.0007 Å |
| c | 14.1954 ± 0.0015 Å |
| α | 90° |
| β | 119.488 ± 0.002° |
| γ | 90° |
| Cell volume | 2446.7 ± 0.4 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.0217 |
| Residual factor for significantly intense reflections | 0.0206 |
| Weighted residual factors for significantly intense reflections | 0.0551 |
| Weighted residual factors for all reflections included in the refinement | 0.0558 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.084 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 280746 (current) | 2023-02-02 | cif/ Adding structures of 8106656 via cif-deposit CGI script. |
8106656.cif |
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Users of the data should acknowledge the original authors of the
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