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Information card for entry 8105485
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| Coordinates | 8105485.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | 2-azido-N-(4-nitrophenyl)acetamide |
|---|---|
| Formula | C8 H7 N5 O3 |
| Calculated formula | C8 H7 N5 O3 |
| Title of publication | Synthesis and crystal structure of 2-azido-N-(4-nitrophenyl)acetamide, C8H7N5O3 |
| Authors of publication | Missioui, Mohcine; Guerrab, Walid; Mague, Joel T.; Ramli, Youssef |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2020 |
| Journal volume | 235 |
| Journal issue | 6 |
| Pages of publication | 1429 - 1430 |
| a | 5.034 ± 0.0002 Å |
| b | 21.1023 ± 0.0009 Å |
| c | 9.288 ± 0.0004 Å |
| α | 90° |
| β | 94.909 ± 0.001° |
| γ | 90° |
| Cell volume | 983.04 ± 0.07 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0601 |
| Residual factor for significantly intense reflections | 0.047 |
| Weighted residual factors for significantly intense reflections | 0.14 |
| Weighted residual factors for all reflections included in the refinement | 0.1496 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.085 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 276191 (current) | 2022-06-23 | cif/ Adding structures of 8105485 via cif-deposit CGI script. |
8105485.cif |
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