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Information card for entry 7224745
Preview
| Coordinates | 7224745.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C5 H7 Bi N4 O8 |
|---|---|
| Calculated formula | C5 H3 Bi N4 O8 |
| Title of publication | Two new energetic coordination compounds based on Tetrazole-1-acetic acid: Syntheses, crystal structures and their synergistic catalytic effect for thermal decomposition of ammonium perchlorate |
| Authors of publication | Kang, Li; Wei, Zhixian; Song, Jiang-Feng; Qu, Yuanyuan; Wang, Yale |
| Journal of publication | RSC Adv. |
| Year of publication | 2016 |
| a | 8.8215 ± 0.0008 Å |
| b | 11.1197 ± 0.001 Å |
| c | 21.054 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2065.2 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.0407 |
| Residual factor for significantly intense reflections | 0.033 |
| Weighted residual factors for significantly intense reflections | 0.0822 |
| Weighted residual factors for all reflections included in the refinement | 0.0862 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.068 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180613 (current) | 2016-03-30 | cif/ Adding structures of 7224745, 7224746 via cif-deposit CGI script. |
7224745.cif |
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