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Information card for entry 7238077
Preview
| Coordinates | 7238077.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H16 Cl O2 S4 |
|---|---|
| Calculated formula | C25 H16 Cl O2 S4 |
| Title of publication | Clathrate formation by and self-assembled supramolecular structures of a “molecular spring” |
| Authors of publication | Tanaka, Kazuhiko; Osuga, Hideji; Kitahara, Yoshinori |
| Journal of publication | Journal of the Chemical Society, Perkin Transactions 2 |
| Year of publication | 2000 |
| Journal issue | 12 |
| Pages of publication | 2492 |
| a | 8.612 ± 0.002 Å |
| b | 29.042 ± 0.003 Å |
| c | 18.387 ± 0.003 Å |
| α | 90° |
| β | 101.77 ± 0.02° |
| γ | 90° |
| Cell volume | 4502.1 ± 1.4 Å3 |
| Cell temperature | 299.2 K |
| Ambient diffraction temperature | 299.2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for significantly intense reflections | 0.0535 |
| Weighted residual factors for significantly intense reflections | 0.0472 |
| Goodness-of-fit parameter for significantly intense reflections | 2.78 |
| Diffraction radiation wavelength | 1.5418 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 243869 (current) | 2019-11-28 | cif/ Adding structures of 7238075, 7238076, 7238077, 7238078, 7238079 via cif-deposit CGI script. |
7238077.cif |
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Users of the data should acknowledge the original authors of the
structural data.