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Information card for entry 1561829
Preview
| Coordinates | 1561829.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C22 H14 N2 O4 S2 Zn |
|---|---|
| Calculated formula | C22 H14 N2 O4 S2 Zn |
| Title of publication | Unraveling the multi-functional behavior in a series of Metal Organic Frameworks |
| Authors of publication | Sanda, Suresh; Biswas, Soumava; Parshamoni, Srinivasulu; Konar, Sanjit |
| Journal of publication | Journal of Solid State Chemistry |
| Year of publication | 2015 |
| Journal volume | 229 |
| Pages of publication | 103 - 111 |
| a | 11.1182 ± 0.0008 Å |
| b | 11.2423 ± 0.0009 Å |
| c | 11.6976 ± 0.0009 Å |
| α | 65.31 ± 0.002° |
| β | 74.889 ± 0.002° |
| γ | 72.067 ± 0.002° |
| Cell volume | 1249.08 ± 0.17 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0868 |
| Residual factor for significantly intense reflections | 0.059 |
| Weighted residual factors for significantly intense reflections | 0.1231 |
| Weighted residual factors for all reflections included in the refinement | 0.1321 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 264206 (current) | 2021-04-15 | cif/ Adding structures of 1561829 via cif-deposit CGI script. |
1561829.cif |
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Users of the data should acknowledge the original authors of the
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