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Information card for entry 8106088
Preview
| Coordinates | 8106088.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C56 H48 Ca2 Cl8 N4 O12 |
|---|---|
| Calculated formula | C56 H48 Ca2 Cl8 N4 O12 |
| Title of publication | Crystal structure of catena-poly[diaqua-bis(μ2-2-(2-((2,6-dichlorophenyl)amino)phenyl)acetato-κ3 O,O′:O′)calcium(II)], C56H48N4Ca2Cl8O12 |
| Authors of publication | Duan, Ying; Li, Shi-Hui |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2018 |
| Journal volume | 233 |
| Journal issue | 2 |
| Pages of publication | 169 - 171 |
| a | 16.776 ± 0.008 Å |
| b | 24.193 ± 0.012 Å |
| c | 7.657 ± 0.004 Å |
| α | 90° |
| β | 101.11 ± 0.007° |
| γ | 90° |
| Cell volume | 3049 ± 3 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.16 |
| Residual factor for significantly intense reflections | 0.0685 |
| Weighted residual factors for significantly intense reflections | 0.1287 |
| Weighted residual factors for all reflections included in the refinement | 0.1663 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.99 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 279282 (current) | 2022-11-15 | cif/ Adding structures of 8106088 via cif-deposit CGI script. |
8106088.cif |
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