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Information card for entry 7206512
Preview
| Coordinates | 7206512.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C32 H37 Br4 N8 O10.5 Zn2 |
|---|---|
| Calculated formula | C32 H37 Br4 N8 O10.5 Zn2 |
| Title of publication | Coordination polymers and metallomacrocycles based on bis(pyridylcarbamate) ligands with flexible glycol spacers |
| Authors of publication | Xia, Yana; Li, Shaoguang; Wu, Biao; Liu, Yanyan; Yang, Xiao-Juan |
| Journal of publication | CrystEngComm |
| Year of publication | 2011 |
| Journal volume | 13 |
| Journal issue | 19 |
| Pages of publication | 5763 |
| a | 7.8072 ± 0.0018 Å |
| b | 10.931 ± 0.003 Å |
| c | 13.796 ± 0.003 Å |
| α | 78.771 ± 0.004° |
| β | 78.627 ± 0.003° |
| γ | 87.263 ± 0.004° |
| Cell volume | 1132.1 ± 0.5 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0516 |
| Residual factor for significantly intense reflections | 0.0351 |
| Weighted residual factors for significantly intense reflections | 0.0847 |
| Weighted residual factors for all reflections included in the refinement | 0.0905 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.089 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301863 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/20/ Each referenced PubChem compound corresponds to the full crystal structure. |
7206512.cif |
| 176453 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7206512.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7206512.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7206512.cif |
| 28003 | 2011-10-13 | ../uploads/cif-deposit/cod/cif Adding structures of 7206510, 7206511, 7206512, 7206513, 7206514, 7206515 via cif-deposit CGI script. |
7206512.cif |
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Users of the data should acknowledge the original authors of the
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