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CIF Information Card
Information card for 2200008
2200007 << 2200008 >> 2200009Preview
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Coordinates |
2200008.cif |
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Structure factors |
2200008.hkl |
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Original IUCr paper |
HTML |
Structure parameters
| Chemical name | 3-Hydroxypyridinium-1-acetate dihydrate |
| Formula | - C7 H11 N O5 - |
| Calculated formula | - C7 H11 N O5 - |
| Title of publication | 3-Hydroxypyridinium-1-acetate dihydrate |
| Authors of publication | Zhu-Yan Zhang; Li-Hua Huo; Shan Gao; Jing-Gui Zhao |
| Journal of publication | Acta Crystallographica, Section E |
| Year of publication | 2005 |
| Journal volume | 61 |
| Journal issue | 11 |
| Pages of publication | o3589 - o3591 |
| a | 6.9055 ± 0.0014 Å |
| b | 7.0086 ± 0.0014 Å |
| c | 10.074 ± 0.002 Å |
| α | 71.62 ± 0.03° |
| β | 76.09 ± 0.03° |
| γ | 71.93 ± 0.03° |
| Cell volume | 434.34 ± 0.18 Å3 |
| Cell temperature | 295 ± 2 K |
| Ambient diffraction temperature | 295 ± 2 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.0518 |
| Residual factor for observed reflections | 0.0402 |
| Weighted residual factors for the observed reflections | 0.1066 |
| Weighted residual factors for all reflections included in the refinement | 0.1128 |
| Goodness-of-fit parameter for observed reflections | 1.093 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |