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Information card for entry 4002648
Preview
| Coordinates | 4002648.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C35.75 H25.8 N3.28 O8 Zn2 |
|---|---|
| Calculated formula | C35.745 H25.796 N3.28233 O8 Zn2 |
| Title of publication | Multicomponent Metal‒Organic Frameworks as Defect-Tolerant Materials |
| Authors of publication | Lee, Seok J.; Doussot, Celine; Baux, Anthony; Liu, Lujia; Jameson, Geoffrey B.; Richardson, Christopher; Pak, Joshua J.; Trousselet, Fabien; Coudert, François-Xavier; Telfer, Shane G. |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2016 |
| Journal volume | 28 |
| Journal issue | 1 |
| Pages of publication | 368 |
| a | 32.8817 ± 0.0005 Å |
| b | 32.8817 ± 0.0005 Å |
| c | 40.272 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 37709 ± 3 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 148 |
| Hermann-Mauguin space group symbol | R -3 :H |
| Hall space group symbol | -R 3 |
| Residual factor for all reflections | 0.0931 |
| Residual factor for significantly intense reflections | 0.0775 |
| Weighted residual factors for significantly intense reflections | 0.2572 |
| Weighted residual factors for all reflections included in the refinement | 0.2665 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.128 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 175778 (current) | 2016-02-04 | cif/ Updating files of 4002645, 4002646, 4002647, 4002648 Original log message: Adding full bibliography for 4002645--4002648.cif. |
4002648.cif |
| 171812 | 2016-01-01 | cif/ Adding structures of 4002645, 4002646, 4002647, 4002648 via cif-deposit CGI script. |
4002648.cif |
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Users of the data should acknowledge the original authors of the
structural data.