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Information card for entry 1569808
Preview
| Coordinates | 1569808.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H17 Cd N9 O S2 |
|---|---|
| Calculated formula | C16 H17 Cd N9 O S2 |
| Title of publication | X-ray Structures and Hirshfeld Studies of Two Dinuclear Cd(II) Complexes with a s-Triazine/Pyrazolo Ligand and Pesudohalides as a Linker |
| Authors of publication | Soliman, Saied M.; Al-Rasheed, Hessa H.; AL-khamis, Sarah A.; Haukka, Matti; El-Faham, Ayman |
| Journal of publication | Crystals |
| Year of publication | 2023 |
| Journal volume | 13 |
| Journal issue | 8 |
| Pages of publication | 1198 |
| a | 14.6614 ± 0.0005 Å |
| b | 15.9147 ± 0.0006 Å |
| c | 18.0194 ± 0.0007 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4204.5 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.0533 |
| Residual factor for significantly intense reflections | 0.0297 |
| Weighted residual factors for significantly intense reflections | 0.0619 |
| Weighted residual factors for all reflections included in the refinement | 0.075 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.099 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 286225 (current) | 2023-09-06 | cif/ Adding structures of 1569808 via cif-deposit CGI script. |
1569808.cif |
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Users of the data should acknowledge the original authors of the
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