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Information card for entry 8106887
Preview
| Coordinates | 8106887.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C14 H16 Cl N2 Nd O8 |
|---|---|
| Calculated formula | C14 H16 Cl N2 Nd O8 |
| Title of publication | Crystal structure of diaqua-bis(μ3-2-methyl-6-oxidopyridinium-4-carboxylato-κ3 O:O′:O′′)neodymium(III) chloride, C14H16ClN2O8Nd |
| Authors of publication | Li, Rong-Fang; Li, Jin; Wang, Ke-Qiang; Huo, Su Zhen |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2016 |
| Journal volume | 231 |
| Journal issue | 2 |
| Pages of publication | 403 - 404 |
| a | 10.3597 ± 0.0015 Å |
| b | 10.3597 ± 0.0015 Å |
| c | 32.729 ± 0.01 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3512.6 ± 1.3 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 88 |
| Hermann-Mauguin space group symbol | I 41/a :2 |
| Hall space group symbol | -I 4ad |
| Residual factor for all reflections | 0.0313 |
| Residual factor for significantly intense reflections | 0.0234 |
| Weighted residual factors for significantly intense reflections | 0.0588 |
| Weighted residual factors for all reflections included in the refinement | 0.0625 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.998 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 281744 (current) | 2023-03-08 | cif/ Adding structures of 8106887 via cif-deposit CGI script. |
8106887.cif |
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