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Information card for entry 4510247
Preview
| Coordinates | 4510247.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H53 Cu2 Ge N8 O44.5 W12 |
|---|---|
| Calculated formula | C32 H44 Cu2 Ge N8 O44.5 W12 |
| Title of publication | Reversible Dehydration in Polyoxometalate-Based Hybrid Compounds: A Study of Single-Crystal to Single-Crystal Transformations in Keggin-Type Germanotungstates Decorated with Copper(II) Complexes of Tetradentate N-Donor Ligands |
| Authors of publication | Iturrospe, Amaia; San Felices, Leire; Reinoso, Santiago; Artetxe, Beñat; Lezama, Luis; Gutiérrez-Zorrilla, Juan M. |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2014 |
| Journal volume | 14 |
| Journal issue | 5 |
| Pages of publication | 2318 |
| a | 11.54269 ± 0.00008 Å |
| b | 22.41402 ± 0.00014 Å |
| c | 25.84917 ± 0.00016 Å |
| α | 90° |
| β | 102.449 ± 0.0007° |
| γ | 90° |
| Cell volume | 6530.4 ± 0.08 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0564 |
| Residual factor for significantly intense reflections | 0.0554 |
| Weighted residual factors for significantly intense reflections | 0.1447 |
| Weighted residual factors for all reflections included in the refinement | 0.1456 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.132 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| 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. |
4510247.cif |
| 115655 | 2014-06-05 | cif/ Updating files of 4510247, 4510248, 4510249, 4510250, 4510251 Original log message: Adding full bibliography for 4510247--4510251.cif. |
4510247.cif |
| 108433 | 2014-04-02 | cif/ Adding structures of 4510247, 4510248, 4510249, 4510250, 4510251 via cif-deposit CGI script. |
4510247.cif |
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Users of the data should acknowledge the original authors of the
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