Information card for entry 7064376
| Formula |
C2.72 H1.45 Cu0.06 N0.23 O0.45 |
| Calculated formula |
C2.71698 H1.45283 Cu0.0566038 N0.226415 O0.45283 |
| Title of publication |
Characterizing the decomposition of CL-20 catalyzed by hydrophobic porphyrin MOFs |
| Authors of publication |
Wang, Taihe; Zou, Chengling; Li, Yu; Mu, Yuxin; Wei, Jiale; Chen, Chao; Zhang, Yan; Li, Haijian; Yi, Jianhua; Ma, Haixia; Zhao, Fengqi |
| Journal of publication |
New Journal of Chemistry |
| Year of publication |
2026 |
| a |
18.973 ± 0.0003 Å |
| b |
19.4512 ± 0.0002 Å |
| c |
25.4299 ± 0.0004 Å |
| α |
74.131 ± 0.001° |
| β |
88.579 ± 0.001° |
| γ |
70.066 ± 0.001° |
| Cell volume |
8462 ± 0.2 Å3 |
| Cell temperature |
293 ± 2 K |
| Ambient diffraction temperature |
293 ± 2 K |
| Number of distinct elements |
5 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0969 |
| Residual factor for significantly intense reflections |
0.0771 |
| Weighted residual factors for significantly intense reflections |
0.2212 |
| Weighted residual factors for all reflections included in the refinement |
0.2383 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.041 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/7064376.html
