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Information card for entry 7239234
Preview
| Coordinates | 7239234.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H22 O8 |
|---|---|
| Calculated formula | C20 H22 O8 |
| Title of publication | Design, synthesis, and preliminary biological evaluation of novel ketone derivatives of shikimic acid |
| Authors of publication | Jiang, Min; Xiong, Bing; Shen, Yu-mei; Yang, Chunhao |
| Journal of publication | RSC Advances |
| Year of publication | 2013 |
| Journal volume | 3 |
| Journal issue | 43 |
| Pages of publication | 20599 |
| a | 8.9355 ± 0.0009 Å |
| b | 10.2534 ± 0.0011 Å |
| c | 22.396 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2051.9 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0511 |
| Residual factor for significantly intense reflections | 0.0409 |
| Weighted residual factors for significantly intense reflections | 0.0916 |
| Weighted residual factors for all reflections included in the refinement | 0.0964 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.985 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 244611 (current) | 2019-11-28 | cif/ Adding structures of 7239234 via cif-deposit CGI script. |
7239234.cif |
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