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Information card for entry 8107352
Preview
| Coordinates | 8107352.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H18 O8 Zn |
|---|---|
| Calculated formula | C16 H18 O8 Zn |
| Title of publication | Crystal structure of diaqua-bis(4-(hydroxymethyl)-benzoato-k1 O)zinc(II), C16H18O8Zn |
| Authors of publication | Huang, Yujiao; Li, Ben; Miao, Siyi; Luo, Linhui; Pang, Haixia; Tang, Qiang |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2023 |
| Journal volume | 238 |
| Journal issue | 1 |
| Pages of publication | 57 - 59 |
| a | 12.152 ± 0.002 Å |
| b | 5.0051 ± 0.0008 Å |
| c | 27.273 ± 0.005 Å |
| α | 90° |
| β | 101.536 ± 0.007° |
| γ | 90° |
| Cell volume | 1625.3 ± 0.5 Å3 |
| Cell temperature | 296 ± 1 K |
| Ambient diffraction temperature | 296 ± 1 K |
| Number of distinct elements | 4 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | I 1 2/a 1 |
| Hall space group symbol | -I 2ya |
| Residual factor for all reflections | 0.0865 |
| Residual factor for significantly intense reflections | 0.0516 |
| Weighted residual factors for significantly intense reflections | 0.125 |
| Weighted residual factors for all reflections included in the refinement | 0.1428 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.999 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 284456 (current) | 2023-06-13 | cif/ Adding structures of 8107352 via cif-deposit CGI script. |
8107352.cif |
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Users of the data should acknowledge the original authors of the
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