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Information card for entry 2200807
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| Coordinates | 2200807.cif |
|---|---|
| Structure factors | 2200807.hkl |
| Original IUCr paper | HTML |
| Common name | maleic anhydride |
|---|---|
| Chemical name | 2,5-furandione |
| Formula | C4 H2 O3 |
| Calculated formula | C4 H2 O3 |
| SMILES | O=C1C=CC(=O)O1 |
| Title of publication | Maleic anhydride, redetermination at 130K |
| Authors of publication | Lutz, Martin |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2001 |
| Journal volume | 57 |
| Journal issue | 11 |
| Pages of publication | o1136 - o1138 |
| a | 7.0317 ± 0.0001 Å |
| b | 11.0201 ± 0.0002 Å |
| c | 5.3323 ± 0.0001 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 413.2 ± 0.012 Å3 |
| Cell temperature | 130 ± 2 K |
| Ambient diffraction temperature | 130 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.031 |
| Residual factor for significantly intense reflections | 0.027 |
| Weighted residual factors for all reflections included in the refinement | 0.07 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.93 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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Users of the data should acknowledge the original authors of the
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