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Information card for entry 8107397
Preview
| Coordinates | 8107397.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C14 H16 Co N6 O8 |
|---|---|
| Calculated formula | C14 H16 Co N6 O8 |
| Title of publication | The crystal structure of diaqua-bis(pyrazolo[1,5-a]pyrimidine-3-carboxylato-κ2 N,O)-cobalt(II) dihydrate, C14H16N6O8Co |
| Authors of publication | Hong, Dong-Feng; Guo, Ao; Kou, Xian-Ke |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2023 |
| Journal volume | 238 |
| Journal issue | 2 |
| Pages of publication | 211 - 213 |
| a | 6.352 ± 0.0006 Å |
| b | 11.7438 ± 0.0008 Å |
| c | 11.788 ± 0.0009 Å |
| α | 90° |
| β | 96.562 ± 0.009° |
| γ | 90° |
| Cell volume | 873.58 ± 0.12 Å3 |
| Cell temperature | 290 ± 2 K |
| Ambient diffraction temperature | 290 ± 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 | 0.0757 |
| Residual factor for significantly intense reflections | 0.0508 |
| Weighted residual factors for significantly intense reflections | 0.0891 |
| Weighted residual factors for all reflections included in the refinement | 0.0982 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 284504 (current) | 2023-06-20 | cif/ Adding structures of 8107397 via cif-deposit CGI script. |
8107397.cif |
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Users of the data should acknowledge the original authors of the
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