Information card for entry 4517824
| Formula |
C28 H56 N18 O20 |
| Calculated formula |
C28 H56 N18 O20 |
| Title of publication |
Derivatives of 3,6-Bis(3-aminofurazan-4-ylamino)-1,2,4,5-tetrazine: Excellent Energetic Properties with Lower Sensitivities. |
| Authors of publication |
Yu, Qiong; Yang, Hongwei; Imler, Gregory H.; Parrish, Damon A.; Cheng, Guangbin; Shreeve, Jean'ne M. |
| Journal of publication |
ACS applied materials & interfaces |
| Year of publication |
2020 |
| a |
9.7943 ± 0.0011 Å |
| b |
10.4746 ± 0.0013 Å |
| c |
13.0589 ± 0.0018 Å |
| α |
97.585 ± 0.004° |
| β |
90.245 ± 0.004° |
| γ |
114.797 ± 0.003° |
| Cell volume |
1202.9 ± 0.3 Å3 |
| Cell temperature |
173 ± 2 K |
| Ambient diffraction temperature |
173 ± 2 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 |
0.1334 |
| Residual factor for significantly intense reflections |
0.0473 |
| Weighted residual factors for significantly intense reflections |
0.079 |
| Weighted residual factors for all reflections included in the refinement |
0.0996 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.015 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/4517824.html
