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Information card for entry 2101966
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| Coordinates | 2101966.cif |
|---|---|
| Structure factors | 2101966.hkl |
| Original IUCr paper | HTML |
| Formula | C25 H58 N4 O10 |
|---|---|
| Calculated formula | C25 H58 N4 O10 |
| Title of publication | Channel- and layer-type anionic host structures in inclusion compounds of urea, tetraalkylammonium terephthalate/trimesate and water |
| Authors of publication | Feng Xue; Thomas C. W. Mak |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 2000 |
| Journal volume | 56 |
| Journal issue | 1 |
| Pages of publication | 142 - 154 |
| a | 9.432 ± 0.001 Å |
| b | 12.601 ± 0.001 Å |
| c | 14.804 ± 0.001 Å |
| α | 79.98 ± 0.01° |
| β | 79.2 ± 0.01° |
| γ | 84.18 ± 0.01° |
| Cell volume | 1697.7 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0824 |
| Residual factor for significantly intense reflections | 0.069 |
| Weighted residual factors for all reflections included in the refinement | 0.1925 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.112 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
Version history
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public domain and licensed under the
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.
Users of the data should acknowledge the original authors of the
structural data.