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Information card for entry 8107194
Preview
| Coordinates | 8107194.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C11 H13 N9 O9 |
|---|---|
| Calculated formula | C11 H13 N9 O9 |
| Title of publication | Crystal structure of 1,2-bis(2,4-dinitro-1H-imidazol-1-yl)ethane – dimethylformamide (1/1), C11H13N9O9 |
| Authors of publication | Jun, Yuan; Bingheng, Wu; Yong, Wang; Jianlong, Wang; Duanlin, Cao; Lizhen, Chen |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2022 |
| Journal volume | 237 |
| Journal issue | 4 |
| Pages of publication | 705 - 706 |
| a | 8.6588 ± 0.0003 Å |
| b | 8.7538 ± 0.0003 Å |
| c | 11.7312 ± 0.0004 Å |
| α | 78.23 ± 0.001° |
| β | 82.06 ± 0.001° |
| γ | 76.031 ± 0.001° |
| Cell volume | 841.05 ± 0.05 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 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 | 0.0492 |
| Residual factor for significantly intense reflections | 0.0376 |
| Weighted residual factors for significantly intense reflections | 0.0914 |
| Weighted residual factors for all reflections included in the refinement | 0.1006 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.989 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 283723 (current) | 2023-05-12 | cif/ Adding structures of 8107194 via cif-deposit CGI script. |
8107194.cif |
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Users of the data should acknowledge the original authors of the
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