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Information card for entry 8106796
Preview
| Coordinates | 8106796.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H21 Mn N3 O10 |
|---|---|
| Calculated formula | C16 H21 Mn N3 O10 |
| Title of publication | Crystal structure of catena-poly[hexaaquabis(μ2-3-nitrophthalate-κ2 O:O′)-(μ2-1,4-bis(4-pyridylmethyl)piperazine-κ2 N:N′)dimanganese(II)] dihydrate, C32H42Mn2N6O20 |
| Authors of publication | Wei-Dong, Yin; Yu-Hao, Duan; Gui-Lian, Li |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2016 |
| Journal volume | 231 |
| Journal issue | 1 |
| Pages of publication | 97 - 99 |
| a | 10.2 ± 0.002 Å |
| b | 19.893 ± 0.004 Å |
| c | 11.3785 ± 0.0017 Å |
| α | 90° |
| β | 123.118 ± 0.012° |
| γ | 90° |
| Cell volume | 1933.7 ± 0.7 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0762 |
| Residual factor for significantly intense reflections | 0.0602 |
| Weighted residual factors for significantly intense reflections | 0.1551 |
| Weighted residual factors for all reflections included in the refinement | 0.1673 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.077 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 281210 (current) | 2023-03-01 | cif/ Adding structures of 8106796 via cif-deposit CGI script. |
8106796.cif |
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Users of the data should acknowledge the original authors of the
structural data.