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Information card for entry 7236181
Preview
| Coordinates | 7236181.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C46 H70 Cd2 Cr3 N11 O41 |
|---|---|
| Calculated formula | C46 H51 Cd2 Cr3 N10 O38 |
| 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 | 20.608 ± 0.002 Å |
| b | 20.608 ± 0.002 Å |
| c | 22.35 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 9491.8 ± 1.6 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 114 |
| Hermann-Mauguin space group symbol | P -4 21 c |
| Hall space group symbol | P -4 2n |
| Residual factor for all reflections | 0.0738 |
| Residual factor for significantly intense reflections | 0.0562 |
| Weighted residual factors for significantly intense reflections | 0.1568 |
| Weighted residual factors for all reflections included in the refinement | 0.1716 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.103 |
| Diffraction radiation wavelength | 0.41328 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| 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. |
7236181.cif |
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Users of the data should acknowledge the original authors of the
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