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Information card for entry 7219727
Preview
| Coordinates | 7219727.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C48 H36 N4 O11 Zn |
|---|---|
| Calculated formula | C48 H36 N4 O11 Zn |
| Title of publication | Functionalities and architectures of coordination polymers with multi-dimensionalities via transition metal–dicarboxylate ligands |
| Authors of publication | Cao, Xinyu; Li, Ling; Li, Changxia; Lv, Lei; Huang, Rudan |
| Journal of publication | CrystEngComm |
| Year of publication | 2015 |
| Journal volume | 17 |
| Journal issue | 11 |
| Pages of publication | 2398 |
| a | 10.1894 ± 0.0013 Å |
| b | 10.3988 ± 0.0013 Å |
| c | 21.838 ± 0.002 Å |
| α | 92.912 ± 0.009° |
| β | 103.316 ± 0.01° |
| γ | 111.412 ± 0.012° |
| Cell volume | 2072.9 ± 0.5 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 | 0.147 |
| Residual factor for significantly intense reflections | 0.0647 |
| Weighted residual factors for significantly intense reflections | 0.0746 |
| Weighted residual factors for all reflections included in the refinement | 0.1058 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.932 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301864 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/21/ Each referenced PubChem compound corresponds to the full crystal structure. |
7219727.cif |
| 180528 | 2016-03-26 | cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/97. |
7219727.cif |
| 133055 | 2015-03-05 | cif/ Adding structures of 7219727, 7219728, 7219729 via cif-deposit CGI script. |
7219727.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.