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Information card for entry 1547797
Preview
| Coordinates | 1547797.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C14 H24 N O4 Re |
|---|---|
| Calculated formula | C14 H24 N O4 Re |
| Title of publication | Deoxydehydration of vicinal diols and polyols catalyzed by pyridinium perrhenate salts |
| Authors of publication | Morris, Danny S.; van Rees, Karlotta; Curcio, Massimiliano; Cokoja, Mirza; Kühn, Fritz E.; Duarte, Fernanda; Love, Jason B. |
| Journal of publication | Catal. Sci. Technol. |
| Year of publication | 2017 |
| a | 8.9052 ± 0.0002 Å |
| b | 8.4384 ± 0.0001 Å |
| c | 10.9159 ± 0.0002 Å |
| α | 90° |
| β | 90.016 ± 0.002° |
| γ | 90° |
| Cell volume | 820.28 ± 0.03 Å3 |
| Cell temperature | 170 ± 2 K |
| Ambient diffraction temperature | 170 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 11 |
| Hermann-Mauguin space group symbol | P 1 21/m 1 |
| Hall space group symbol | -P 2yb |
| Residual factor for all reflections | 0.0214 |
| Residual factor for significantly intense reflections | 0.0203 |
| Weighted residual factors for significantly intense reflections | 0.0442 |
| Weighted residual factors for all reflections included in the refinement | 0.0445 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.308 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 202333 (current) | 2017-10-26 | cif/ Adding structures of 1547792, 1547793, 1547794, 1547795, 1547796, 1547797, 1547798 via cif-deposit CGI script. |
1547797.cif |
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Users of the data should acknowledge the original authors of the
structural data.