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Information card for entry 7156882
Preview
| Coordinates | 7156882.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C19 H20 O6 |
|---|---|
| Calculated formula | C19 H20 O6 |
| Title of publication | Synthesis and evaluation of antiproliferative microtubule-destabilising combretastatin A-4 piperazine conjugates. |
| Authors of publication | O'Boyle, Niamh M; Ana, Gloria; Kelly, Patrick M.; Nathwani, Seema M.; Noorani, Sara; Fayne, Darren; Bright, Sandra A.; Twamley, Brendan; Zisterer, Daniela M.; Meegan, Mary J. |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2019 |
| Journal volume | 17 |
| Journal issue | 25 |
| Pages of publication | 6184 - 6200 |
| a | 7.7673 ± 0.0002 Å |
| b | 8.9291 ± 0.0003 Å |
| c | 12.6819 ± 0.0004 Å |
| α | 99.235 ± 0.002° |
| β | 90.839 ± 0.002° |
| γ | 93.211 ± 0.002° |
| Cell volume | 866.54 ± 0.05 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0686 |
| Residual factor for significantly intense reflections | 0.0518 |
| Weighted residual factors for significantly intense reflections | 0.138 |
| Weighted residual factors for all reflections included in the refinement | 0.1501 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 225178 (current) | 2019-11-08 | cif/ Updating files of 7156882 Original log message: Adding full bibliography for 7156882.cif. |
7156882.cif |
| 215600 | 2019-05-30 | cif/ Adding structures of 7156882 via cif-deposit CGI script. |
7156882.cif |
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Users of the data should acknowledge the original authors of the
structural data.