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Information card for entry 7233127
Preview
| Coordinates | 7233127.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C18 H20 Cl2 N2 O12 |
|---|---|
| Calculated formula | C18 H20 Cl2 N2 O12 |
| Title of publication | Tunable solid-state photoluminescence based on proton-triggered structural transformation of 4,4'-bipyridinium derivative |
| Authors of publication | Xue-Jun Zhou; Cheng Chen; Cai-Xia Ren; Jian-Ke Sun; Jie Zhang |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2013 |
| Journal volume | 1 |
| Pages of publication | 744 - 750 |
| a | 7.1914 ± 0.0004 Å |
| b | 7.9109 ± 0.0004 Å |
| c | 20.1775 ± 0.0011 Å |
| α | 96.509 ± 0.007° |
| β | 93.7 ± 0.014° |
| γ | 93.897 ± 0.01° |
| Cell volume | 1134.85 ± 0.11 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0859 |
| Residual factor for significantly intense reflections | 0.0675 |
| Weighted residual factors for significantly intense reflections | 0.1189 |
| Weighted residual factors for all reflections included in the refinement | 0.1275 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7233127.cif |
| 217037 | 2019-07-15 | cif/ Adding structures of 7233127 via cif-deposit CGI script. |
7233127.cif |
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Users of the data should acknowledge the original authors of the
structural data.