Information card for entry 8106800
| Formula |
C17 H14 O7 |
| Calculated formula |
C17 H14 O7 |
| Title of publication |
Crystal structure of 3′,4′,5-trihydroxy-3,7-dimethoxyflavone, C17H14O7 |
| Authors of publication |
Brito, Iván; Simirgiotis, Mario; Jerz, Gerold; Werner, Miriam Rodríguez; Bórques, Jorge; Winterhalter, Peter; Cárdenas, Alejandro |
| Journal of publication |
Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication |
2016 |
| Journal volume |
231 |
| Journal issue |
1 |
| Pages of publication |
113 - 115 |
| a |
11.667 ± 0.0004 Å |
| b |
11.3338 ± 0.0004 Å |
| c |
11.6415 ± 0.0004 Å |
| α |
90° |
| β |
110.269 ± 0.001° |
| γ |
90° |
| Cell volume |
1444.05 ± 0.09 Å3 |
| Cell temperature |
295 ± 2 K |
| Ambient diffraction temperature |
295 ± 2 K |
| Number of distinct elements |
3 |
| Space group number |
14 |
| Hermann-Mauguin space group symbol |
P 1 21/c 1 |
| Hall space group symbol |
-P 2ybc |
| Residual factor for all reflections |
0.0531 |
| Residual factor for significantly intense reflections |
0.0383 |
| Weighted residual factors for significantly intense reflections |
0.0926 |
| Weighted residual factors for all reflections included in the refinement |
0.1005 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.04 |
| Diffraction radiation wavelength |
1.54178 Å |
| Diffraction radiation type |
CuKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/8106800.html
