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Information card for entry 7044768
Preview
| Coordinates | 7044768.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C53 H65.5 Cl12 N8 O0.75 Ru |
|---|---|
| Calculated formula | C53 H65.5 Cl12 N8 O0.75 Ru |
| Title of publication | A novel strategy to construct Janus metallamacrocycles with both a Ru‒arene face and an imidazolium face |
| Authors of publication | Li, Ji; Zhang, Peipei; Xu, Yan; Su, Zhi; Qian, Yong; Li, Shunli; Yu, Tao; Sadler, Peter J.; Liu, Hong-Ke |
| Journal of publication | Dalton Transactions |
| Year of publication | 2017 |
| a | 12.964 ± 0.005 Å |
| b | 30.036 ± 0.011 Å |
| c | 15.807 ± 0.006 Å |
| α | 90° |
| β | 106.065 ± 0.004° |
| γ | 90° |
| Cell volume | 5915 ± 4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 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 | 0.104 |
| Residual factor for significantly intense reflections | 0.0765 |
| Weighted residual factors for significantly intense reflections | 0.1639 |
| Weighted residual factors for all reflections included in the refinement | 0.1759 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.197 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 203208 (current) | 2017-11-15 | cif/ Adding structures of 7044768, 7044769, 7044770, 7044771 via cif-deposit CGI script. |
7044768.cif |
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Users of the data should acknowledge the original authors of the
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