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Information card for entry 1564074
Preview
| Coordinates | 1564074.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C17 H22 O8 S2 Zn |
|---|---|
| Calculated formula | C17 H22 O8 S2 Zn |
| Title of publication | A novel approach to achieve molecular switching in solid-state driving by thermal treatment: A photochromic zinc-coordination polymer |
| Authors of publication | Almáši, Miroslav; Walko, Martin; Boržíková, Jana; Gyepes, Róbert |
| Journal of publication | Inorganica Chimica Acta |
| Year of publication | 2020 |
| Journal volume | 512 |
| Pages of publication | 119879 |
| a | 20.333 ± 0.003 Å |
| b | 10.3696 ± 0.0014 Å |
| c | 9.3867 ± 0.0011 Å |
| α | 90° |
| β | 99.726 ± 0.003° |
| γ | 90° |
| Cell volume | 1950.7 ± 0.5 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.1174 |
| Residual factor for significantly intense reflections | 0.0532 |
| Weighted residual factors for significantly intense reflections | 0.0876 |
| Weighted residual factors for all reflections included in the refinement | 0.1041 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.993 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 267420 (current) | 2021-07-09 | cif/ Adding structures of 1564074 via cif-deposit CGI script. |
1564074.cif |
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Users of the data should acknowledge the original authors of the
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