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Information card for entry 7041508
Preview
| Coordinates | 7041508.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C77 H118 Cl6 Cu5 N16 O38 |
|---|---|
| Calculated formula | C77 H118 Cl6 Cu5 N16 O38 |
| Title of publication | The synthesis of three new Cu5, Cu8 and Cu12 clusters via the use of a semi-flexible aminotriazine-based bis-methylpyridine ligand. |
| Authors of publication | Chiang, Chun-Hung; Tzeng, Yen-Wen; Yang, Chen-I; Nakano, Motohiro; Wan, Wun-Long; Lai, Long-Li; Lee, Gene-Hsiang |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2017 |
| Journal volume | 46 |
| Journal issue | 4 |
| Pages of publication | 1237 - 1248 |
| a | 12.0191 ± 0.0002 Å |
| b | 15.0776 ± 0.0002 Å |
| c | 15.5604 ± 0.0002 Å |
| α | 63.8858 ± 0.0006° |
| β | 86.7571 ± 0.0007° |
| γ | 85.2352 ± 0.0007° |
| Cell volume | 2522.61 ± 0.06 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 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 | 0.0884 |
| Residual factor for significantly intense reflections | 0.0613 |
| Weighted residual factors for significantly intense reflections | 0.1683 |
| Weighted residual factors for all reflections included in the refinement | 0.1848 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 191619 (current) | 2017-02-04 | cif/ Updating files of 7041508, 7041509, 7041510 Original log message: Adding full bibliography for 7041508--7041510.cif. |
7041508.cif |
| 189261 | 2016-12-20 | cif/ Adding structures of 7041508, 7041509, 7041510 via cif-deposit CGI script. |
7041508.cif |
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Users of the data should acknowledge the original authors of the
structural data.