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Information card for entry 7231736
Preview
| Coordinates | 7231736.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H14 Hg N6 O S2 |
|---|---|
| Calculated formula | C20 H14 Hg N6 O S2 |
| Title of publication | Modulation of coordination in pincer-type isonicotinohydrazone Schiff base ligands by proton transfer |
| Authors of publication | Mahmoudi, Ghodrat; Khandar, Ali Akbar; Afkhami, Farhad Akbari; Miroslaw, Barbara; Gurbanov, Atash V.; Zubkov, Fedor I.; Kennedy, Alan; Franconetti, Antonio; Frontera, Antonio |
| Journal of publication | CrystEngComm |
| Year of publication | 2019 |
| Journal volume | 21 |
| Journal issue | 1 |
| Pages of publication | 108 |
| a | 28.861 ± 0.006 Å |
| b | 9.191 ± 0.002 Å |
| c | 17.149 ± 0.003 Å |
| α | 90° |
| β | 111.76 ± 0.03° |
| γ | 90° |
| Cell volume | 4224.8 ± 1.7 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0561 |
| Residual factor for significantly intense reflections | 0.0366 |
| Weighted residual factors for significantly intense reflections | 0.083 |
| Weighted residual factors for all reflections included in the refinement | 0.088 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.8291 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 223522 (current) | 2019-11-07 | cif/ Updating files of 7231736, 7231737 Original log message: Adding full bibliography for 7231736--7231737.cif. |
7231736.cif |
| 211713 | 2018-10-31 | cif/ Adding structures of 7231736, 7231737 via cif-deposit CGI script. |
7231736.cif |
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Users of the data should acknowledge the original authors of the
structural data.