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Information card for entry 7061060
Preview
| Coordinates | 7061060.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H16 Mn N4 O3 P S2 |
|---|---|
| Calculated formula | C16 H16 Mn N4 O3 P S2 |
| Title of publication | Mononuclear Mn complexes featuring N,S-/N,N-donor and 1,3,5-triaza-7-phosphaadamantane ligands: synthesis and electrocatalytic properties |
| Authors of publication | Kaim, Vishakha; Kaur-Ghumaan, Sandeep |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2021 |
| Journal volume | 45 |
| Journal issue | 43 |
| Pages of publication | 20272 - 20279 |
| a | 10.0708 ± 0.0007 Å |
| b | 11.9149 ± 0.0008 Å |
| c | 15.6475 ± 0.0011 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1877.6 ± 0.2 Å3 |
| Cell temperature | 150 ± 0.1 K |
| Ambient diffraction temperature | 150 ± 0.1 K |
| Number of distinct elements | 7 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0536 |
| Residual factor for significantly intense reflections | 0.0503 |
| Weighted residual factors for significantly intense reflections | 0.1255 |
| Weighted residual factors for all reflections included in the refinement | 0.1276 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.08 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 270557 (current) | 2021-11-10 | cif/ Adding structures of 7061060 via cif-deposit CGI script. |
7061060.cif |
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