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Information card for entry 4514447
Preview
| Coordinates | 4514447.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C12 H26 N28 O17 |
|---|---|
| Calculated formula | C12 H26 N28 O17 |
| Title of publication | Polynitro-Functionalized Triazolylfurazanate Triaminoguanidine: Novel Green Primary Explosive with Insensitive Nature. |
| Authors of publication | Ma, Jinchao; Tang, Jie; Yang, Hongwei; Yi, Zhenxin; Wu, Ganggang; Zhu, Shunguan; Zhang, Wenchao; Li, Yanchun; Cheng, Guangbin |
| Journal of publication | ACS applied materials & interfaces |
| Year of publication | 2019 |
| Journal volume | 11 |
| Journal issue | 29 |
| Pages of publication | 26053 - 26059 |
| a | 17.537 ± 0.003 Å |
| b | 6.5494 ± 0.001 Å |
| c | 27.351 ± 0.004 Å |
| α | 90° |
| β | 97.532 ± 0.008° |
| γ | 90° |
| Cell volume | 3114.3 ± 0.8 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 4 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.1161 |
| Residual factor for significantly intense reflections | 0.0978 |
| Weighted residual factors for significantly intense reflections | 0.2552 |
| Weighted residual factors for all reflections included in the refinement | 0.2713 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.081 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 219636 (current) | 2019-10-28 | cif/ Adding structures of 4514447 via cif-deposit CGI script. |
4514447.cif |
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Users of the data should acknowledge the original authors of the
structural data.