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Information card for entry 2242180
Preview
| Coordinates | 2242180.cif |
|---|---|
| Structure factors | 2242180.hkl |
| Original IUCr paper | HTML |
| Chemical name | Tris(μ~2~-methanolato)-μ~3~-oxido-tris[(<i>E</i>)-4-chloro-2-({[2-(pyridin-2-yl)ethyl]imino}methyl)phenolato]manganese(III) perchlorate‒dichloromethane‒diethyl ether (1/1.096/0.906) |
|---|---|
| Formula | C49.71 H56.23 Cl6.19 Mn3 N6 O11.9 |
| Calculated formula | C49.7122 H56.2324 Cl6.1924 Mn3 N6 O11.904 |
| Title of publication | Tris(μ~2~-methanolato)-μ~3~-oxido-tris{[(<i>E</i>)-4-chloro-2-({[2-(pyridin-2-yl)ethyl]imino}methyl)phenolato]manganese(III)} perchlorate‒dichloromethane‒diethyl ether (1/1.1/0.9) |
| Authors of publication | Egekenze, Rita; Gultneh, Yilma; Butcher, Ray J. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2017 |
| Journal volume | 73 |
| Journal issue | 8 |
| Pages of publication | 1113 - 1116 |
| a | 16.0002 ± 0.0003 Å |
| b | 19.389 ± 0.0002 Å |
| c | 19.1631 ± 0.0003 Å |
| α | 90° |
| β | 100.073 ± 0.0018° |
| γ | 90° |
| Cell volume | 5853.3 ± 0.16 Å3 |
| Cell temperature | 123 ± 2 K |
| Ambient diffraction temperature | 123 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.1258 |
| Residual factor for significantly intense reflections | 0.0707 |
| Weighted residual factors for significantly intense reflections | 0.1433 |
| Weighted residual factors for all reflections included in the refinement | 0.1664 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.081 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 199150 (current) | 2017-07-25 | cif/ hkl/ Adding structures of 2242180 via cif-deposit CGI script. |
2242180.cif 2242180.hkl |
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Users of the data should acknowledge the original authors of the
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