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Information card for entry 8106700
Preview
| Coordinates | 8106700.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C40 H40 Br4 Cl4 Mn4 O16 |
|---|---|
| Calculated formula | C40 H40 Br4 Cl4 Mn4 O16 |
| Title of publication | Crystal structure of bis(μ3-methanolato-κ3 O:O:O)-bis(μ2-methanolato-κ2 O:O)-dimethanol-bis{6,6′-(1,3-dihydroxyl-2-acetylpropane-1,3-diyl)bis(2-chloro-4-bromophenolato)}tetramanganese(III) C40H40Br4Cl4Mn4O16 |
| Authors of publication | Zhao, Ji-Xing; Zhao, Li; Wang, Fei; An, Qin-Qin; Li, Peng-Peng |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2017 |
| Journal volume | 232 |
| Journal issue | 6 |
| Pages of publication | 851 - 853 |
| a | 9.3724 ± 0.0009 Å |
| b | 11.7867 ± 0.0016 Å |
| c | 12.3994 ± 0.0018 Å |
| α | 70.65 ± 0.013° |
| β | 75.462 ± 0.01° |
| γ | 81.085 ± 0.01° |
| Cell volume | 1247.1 ± 0.3 Å3 |
| Cell temperature | 294.06 ± 0.1 K |
| Ambient diffraction temperature | 294.06 ± 0.1 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 | 0.1218 |
| Residual factor for significantly intense reflections | 0.0618 |
| Weighted residual factors for significantly intense reflections | 0.0942 |
| Weighted residual factors for all reflections included in the refinement | 0.1201 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
| 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 |
|---|---|---|---|
| 280800 (current) | 2023-02-07 | cif/ Adding structures of 8106700 via cif-deposit CGI script. |
8106700.cif |
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Users of the data should acknowledge the original authors of the
structural data.