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Information card for entry 7236180
Preview
| Coordinates | 7236180.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H54 Cr3 Cu3 N13 O49 |
|---|---|
| Calculated formula | C36 H24 Cr3 Cu3 N6 O28 |
| Title of publication | Network diversity through two-step crystal engineering of a decorated 6-connected primary molecular building block |
| Authors of publication | Yang, Qing-Yuan; Chen, Kai-Jie; Schoedel, Alexander; Wojtas, Lukasz; Perry IV, John J.; Zaworotko, Michael J. |
| Journal of publication | CrystEngComm |
| Year of publication | 2016 |
| Journal volume | 18 |
| Journal issue | 44 |
| Pages of publication | 8578 |
| a | 20.772 ± 0.009 Å |
| b | 20.772 ± 0.009 Å |
| c | 21.053 ± 0.001 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 7867 ± 5 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 176 |
| Hermann-Mauguin space group symbol | P 63/m |
| Hall space group symbol | -P 6c |
| Residual factor for all reflections | 0.0887 |
| Residual factor for significantly intense reflections | 0.0726 |
| Weighted residual factors for significantly intense reflections | 0.2137 |
| Weighted residual factors for all reflections included in the refinement | 0.2411 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.089 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 234716 (current) | 2019-11-23 | cif/ Adding structures of 7236179, 7236180, 7236181, 7236182, 7236183 via cif-deposit CGI script. |
7236180.cif |
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