Crystallography Open Database
| COD Home |
|---|
| Accessing COD Data |
|---|
| Add Your Data |
|---|
| Documentation |
|---|
CIF Information Card
Information card for 2015322
2015321 << 2015322 >> 2015323Preview
|
Coordinates |
2015322.cif |
|
Structure factors |
2015322.hkl |
|
Original IUCr paper |
HTML |
Structure parameters
| Chemical name | morpholine-2,5-dione |
| Formula | - C4 H5 N O3 - |
| Calculated formula | - C4 H5 N O3 - |
| Title of publication | Morpholine-2,5-dione |
| Authors of publication | Martínez-Palau, Meritxell; Urpí, Lourdes; Solans, Xavier; Puiggalí, Jordi |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2006 |
| Journal volume | 62 |
| Journal issue | 5 |
| Pages of publication | o262 - o264 |
| a | 5.379 ± 0.005 Å |
| b | 9.218 ± 0.002 Å |
| c | 9.794 ± 0.002 Å |
| α | 90° |
| β | 92.28 ± 0.04° |
| γ | 90° |
| Cell volume | 485.2 ± 0.5 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | P 1 21/n 1 |
| Hall symmetry space group | -P 2yn |
| Residual factor for all reflections | 0.0594 |
| Residual factor for observed reflections | 0.044 |
| Weighted residual factors for the observed reflections | 0.1187 |
| Weighted residual factors for all reflections included in the refinement | 0.1296 |
| Goodness-of-fit parameter for observed reflections | 1.054 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |