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Information card for entry 7701972
Preview
| Coordinates | 7701972.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C13 H19 Cu N6 O |
|---|---|
| Calculated formula | C13 H18 Cu N6 O |
| 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 | 11.3723 ± 0.0002 Å |
| b | 13.5038 ± 0.0002 Å |
| c | 9.4796 ± 0.0001 Å |
| α | 90° |
| β | 93.625 ± 0.001° |
| γ | 90° |
| Cell volume | 1452.86 ± 0.04 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 | 0.0389 |
| Residual factor for significantly intense reflections | 0.0362 |
| Weighted residual factors for significantly intense reflections | 0.1006 |
| Weighted residual factors for all reflections included in the refinement | 0.1026 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.101 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| 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. |
7701972.cif |
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Users of the data should acknowledge the original authors of the
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