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Information card for entry 4510246
Preview
| Coordinates | 4510246.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C19 H14 N2 O9.5 S2 Yb |
|---|---|
| Calculated formula | C19 H14 N2 O9.5 S2 Yb |
| Title of publication | Ln-MOF Pseudo-Merohedral Twinned Crystalline Family as Solvent-Free Heterogeneous Catalysts |
| Authors of publication | D’Vries, Richard F.; Snejko, Natalia; Iglesias, Marta; Gutiérrez-Puebla, Enrique; Monge, M. Angeles |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2014 |
| Journal volume | 14 |
| Journal issue | 5 |
| Pages of publication | 2516 |
| a | 18.6903 ± 0.0007 Å |
| b | 31.1946 ± 0.001 Å |
| c | 6.8692 ± 0.0003 Å |
| α | 90° |
| β | 90.094 ± 0.003° |
| γ | 90° |
| Cell volume | 4005 ± 0.3 Å3 |
| Cell temperature | 571 ± 2 K |
| Ambient diffraction temperature | 571 ± 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 | 0.0554 |
| Residual factor for significantly intense reflections | 0.0457 |
| Weighted residual factors for significantly intense reflections | 0.1078 |
| Weighted residual factors for all reflections included in the refinement | 0.1138 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4510246.cif |
| 115654 | 2014-06-05 | cif/ Updating files of 4510246 Original log message: Adding full bibliography for 4510246.cif. |
4510246.cif |
| 108432 | 2014-04-02 | cif/ Adding structures of 4510246 via cif-deposit CGI script. |
4510246.cif |
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Users of the data should acknowledge the original authors of the
structural data.