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Information card for entry 1553311
Preview
| Coordinates | 1553311.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C19 H18 O2 |
|---|---|
| Calculated formula | C19 H18 O2 |
| Title of publication | Total Synthesis of Tedarene A. |
| Authors of publication | Maurent, Kelly; Vanucci-Bacqué, Corinne; Saffon-Merceron, Nathalie; Baltas, Michel; Bedos-Belval, Florence |
| Journal of publication | Journal of natural products |
| Year of publication | 2017 |
| Journal volume | 80 |
| Journal issue | 5 |
| Pages of publication | 1623 - 1630 |
| a | 9.7921 ± 0.0016 Å |
| b | 11.467 ± 0.0018 Å |
| c | 13.899 ± 0.002 Å |
| α | 88.098 ± 0.005° |
| β | 79.234 ± 0.005° |
| γ | 79.122 ± 0.005° |
| Cell volume | 1505.6 ± 0.4 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 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 | 0.1358 |
| Residual factor for significantly intense reflections | 0.0664 |
| Weighted residual factors for significantly intense reflections | 0.1263 |
| Weighted residual factors for all reflections included in the refinement | 0.1571 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.047 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 234088 (current) | 2019-11-23 | cif/ Adding structures of 1553311 via cif-deposit CGI script. |
1553311.cif |
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Users of the data should acknowledge the original authors of the
structural data.