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Information card for entry 2312705
Preview
| Coordinates | 2312705.cif |
|---|---|
| Structure factors | 2312705.hkl |
| Original IUCr paper | HTML |
| Formula | C40 H32.6 Cu4 Mo4 N8 O16.3 |
|---|---|
| Calculated formula | C40 H32.6 Cu4 Mo4 N8 O16.3 |
| Title of publication | Coordination geometry flexibility driving supramolecular isomerism of Cu/Mo pillared-layer hybrid networks. |
| Authors of publication | Moya, Marielsys; Liendo-Polanco, Gustavo R; Atencio, Reinaldo; Silva, Pedro; Henao, Jose A.; Bruno-Colmenares, Julia |
| Journal of publication | Acta crystallographica Section B, Structural science, crystal engineering and materials |
| Year of publication | 2024 |
| Journal volume | 80 |
| Journal issue | 6 |
| Pages of publication | 782 - 792 |
| a | 9.7136 ± 0.0012 Å |
| b | 23.759 ± 0.003 Å |
| c | 19.9289 ± 0.0017 Å |
| α | 90° |
| β | 103.035 ± 0.011° |
| γ | 90° |
| Cell volume | 4480.8 ± 0.9 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0868 |
| Residual factor for significantly intense reflections | 0.0616 |
| Weighted residual factors for significantly intense reflections | 0.1568 |
| Weighted residual factors for all reflections included in the refinement | 0.168 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.926 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 296756 (current) | 2024-12-07 | cif/ Updating files of 2312705, 2312706, 2312707, 2312708 Original log message: Adding full bibliography for 2312705--2312708.cif. |
2312705.cif 2312705.hkl |
| 296195 | 2024-12-03 | cif/ hkl/ Adding structures of 2312705, 2312706, 2312707, 2312708 via cif-deposit CGI script. |
2312705.cif 2312705.hkl |
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Users of the data should acknowledge the original authors of the
structural data.