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Information card for entry 7220771
Preview
| Coordinates | 7220771.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H22 Cl5 O P Re |
|---|---|
| Calculated formula | C24 H20 Cl5 O P Re |
| SMILES | c1(ccccc1)[P+](c1ccccc1)(c1ccccc1)c1ccccc1.Cl[Re](Cl)([OH2])(Cl)(Cl)Cl |
| Title of publication | Aquapentachlororhenate(IV): a singular and promising building block for metal assembling |
| Authors of publication | Martinez-Lillo, Jose; Armentano, Donatella |
| Journal of publication | RSC Adv. |
| Year of publication | 2015 |
| a | 13.3512 ± 0.0011 Å |
| b | 13.3512 ± 0.0011 Å |
| c | 7.2677 ± 0.0008 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1295.5 ± 0.2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 85 |
| Hermann-Mauguin space group symbol | P 4/n |
| Hall space group symbol | -P 4a |
| Residual factor for all reflections | 0.0813 |
| Residual factor for significantly intense reflections | 0.0804 |
| Weighted residual factors for significantly intense reflections | 0.2639 |
| Weighted residual factors for all reflections included in the refinement | 0.2665 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.28 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 139251 (current) | 2015-06-16 | cif/ Adding structures of 7220771 via cif-deposit CGI script. |
7220771.cif |
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Users of the data should acknowledge the original authors of the
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