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Information card for entry 8107045
Preview
| Coordinates | 8107045.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H19 Cd N2 O5 |
|---|---|
| Calculated formula | C24 H19 Cd N2 O5 |
| Title of publication | Crystal structure of poly[1,4-bis(2-methylbenzimidazol)butane-κ2 N:N′)bis(4,4′-oxybis(benzoato-κ4 O,O′:O′′,O′′′)dicadmium] monohydrate, C48H38Cd2N4O10 |
| Authors of publication | Xu, Chunying; Chu, Wenjuan; Lei, Song; Yang, Xuechun |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2016 |
| Journal volume | 231 |
| Journal issue | 3 |
| Pages of publication | 907 - 909 |
| a | 22.112 ± 0.004 Å |
| b | 9.21 ± 0.0018 Å |
| c | 22.977 ± 0.005 Å |
| α | 90° |
| β | 93.24 ± 0.03° |
| γ | 90° |
| Cell volume | 4671.8 ± 1.6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.0389 |
| Residual factor for significantly intense reflections | 0.0341 |
| Weighted residual factors for significantly intense reflections | 0.0834 |
| Weighted residual factors for all reflections included in the refinement | 0.0868 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 282454 (current) | 2023-04-06 | cif/ Adding structures of 8107045 via cif-deposit CGI script. |
8107045.cif |
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Users of the data should acknowledge the original authors of the
structural data.