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Information card for entry 2008855
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| Coordinates | 2008855.cif |
|---|---|
| Structure factors | 2008855.hkl |
| Original IUCr paper | HTML |
| Chemical name | N,N-bis(N-methylene-2-pyrrolidone)glycine |
|---|---|
| Formula | C12 H19 N3 O4 |
| Calculated formula | C12 H19 N3 O4 |
| SMILES | OC(=O)CN(CN1C(=O)CCC1)CN1C(=O)CCC1 |
| Title of publication | <i>N</i>,<i>N</i>-Bis(2-oxopyrrolidin-1-ylmethyl)glycine |
| Authors of publication | Xiang-Jun Zheng; Zhe-Ming Wang; Yan-Qia Wang; Lin-Pei Jin; Jian-Quan Guo; Chun-Hua Yan |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1999 |
| Journal volume | 55 |
| Journal issue | 8 |
| Pages of publication | 1333 - 1335 |
| a | 13.731 ± 0.0006 Å |
| b | 9.1357 ± 0.0005 Å |
| c | 10.8227 ± 0.0005 Å |
| α | 90° |
| β | 98.852 ± 0.004° |
| γ | 90° |
| Cell volume | 1341.45 ± 0.11 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0784 |
| Residual factor for significantly intense reflections | 0.0445 |
| Weighted residual factors for all reflections included in the refinement | 0.1193 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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