Information card for entry 8105006
| Formula |
C20 H29 N O3 |
| Calculated formula |
C20 H29 N O3 |
| Title of publication |
The co-crystal structure of (17b)-estra-1,3,5(10)-triene-3,17diol – acetamide (1/1), a Z′ = 4 structure, C20H29NO3 |
| Authors of publication |
Gong, Xiao F.; Song, Tao; Ning, Li F.; Chen, Xiao F.; Xu, Juan; Li, Peng; Gou, Ying Z.; Wang, Hui P. |
| Journal of publication |
Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication |
2019 |
| Journal volume |
235 |
| Journal issue |
1 |
| Pages of publication |
31 - 34 |
| a |
16.167 ± 0.003 Å |
| b |
9.3424 ± 0.0019 Å |
| c |
25.656 ± 0.005 Å |
| α |
90° |
| β |
108.27 ± 0.03° |
| γ |
90° |
| Cell volume |
3679.7 ± 1.4 Å3 |
| Cell temperature |
153 ± 2 K |
| Ambient diffraction temperature |
153.15 K |
| Number of distinct elements |
4 |
| Space group number |
4 |
| Hermann-Mauguin space group symbol |
P 1 21 1 |
| Hall space group symbol |
P 2yb |
| Residual factor for all reflections |
0.1104 |
| Residual factor for significantly intense reflections |
0.103 |
| Weighted residual factors for significantly intense reflections |
0.224 |
| Weighted residual factors for all reflections included in the refinement |
0.2296 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.067 |
| 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/8105006.html
