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Information card for entry 7701973
Preview
| Coordinates | 7701973.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C11 H13 Br Cu N6 |
|---|---|
| Calculated formula | C11 H13 Br Cu N6 |
| Title of publication | Coordination-Driven Self-Assembly of M10L8 Metal-Organic Bi-capped Square Antiprisms with Adaptable Cavity |
| Authors of publication | Wang, Xue-Zhi; Sun, Meng-Ying; Zheng, Ji; Luo, Dong; Li, Qi; Zhou, Xiao-Ping; Li, Dan |
| Journal of publication | Dalton Transactions |
| Year of publication | 2019 |
| a | 9.1003 ± 0.0002 Å |
| b | 9.0877 ± 0.0002 Å |
| c | 15.9711 ± 0.0003 Å |
| α | 90° |
| β | 90.77 ± 0.002° |
| γ | 90° |
| Cell volume | 1320.7 ± 0.05 Å3 |
| Cell temperature | 100 ± 0.1 K |
| Ambient diffraction temperature | 100 ± 0.1 K |
| Number of distinct elements | 5 |
| 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 | 0.0568 |
| Residual factor for significantly intense reflections | 0.0455 |
| Weighted residual factors for significantly intense reflections | 0.1181 |
| Weighted residual factors for all reflections included in the refinement | 0.1332 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 231022 (current) | 2019-11-19 | cif/ Adding structures of 7701969, 7701970, 7701971, 7701972, 7701973, 7701974, 7701975, 7701976 via cif-deposit CGI script. |
7701973.cif |
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Users of the data should acknowledge the original authors of the
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