Information card for entry 7060177
| Formula |
C60 H48 N6 O14 |
| Calculated formula |
C60 H48 N6 O14 |
| Title of publication |
The role of 3-OH in the self-assembly of pharmaceutical cocrystals of dihydroflavonol with 4,4′-bipyridine |
| Authors of publication |
Liu, Lixin; Liu, Moqi; Zhang, Yunan; Yin, Hemei; Su, Xin; Zhang, Qiang; Feng, Yanru; Guo, Yingxue; Zou, Dongyu; Liu, Yingli |
| Journal of publication |
New Journal of Chemistry |
| Year of publication |
2021 |
| Journal volume |
45 |
| Journal issue |
3 |
| Pages of publication |
1626 - 1633 |
| a |
8.6073 ± 0.0004 Å |
| b |
8.4846 ± 0.0004 Å |
| c |
34.8953 ± 0.0014 Å |
| α |
90° |
| β |
96.014 ± 0.004° |
| γ |
90° |
| Cell volume |
2534.4 ± 0.2 Å3 |
| Cell temperature |
293 ± 2 K |
| Ambient diffraction temperature |
293 ± 2 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 |
0.0901 |
| Residual factor for significantly intense reflections |
0.0565 |
| Weighted residual factors for significantly intense reflections |
0.1161 |
| Weighted residual factors for all reflections included in the refinement |
0.1304 |
| 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 |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/7060177.html
