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Information card for entry 4087636
Preview
| Coordinates | 4087636.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C48 H70 Fe K O4 S2 Y |
|---|---|
| Calculated formula | C48 H70 Fe K O4 S2 Y |
| Title of publication | Highly Active Yttrium Catalysts for the Ring-Opening Polymerization of ε-Caprolactone and δ-Valerolactone |
| Authors of publication | Wang, Xinke; Brosmer, Jonathan L.; Thevenon, Arnaud; Diaconescu, Paula L. |
| Journal of publication | Organometallics |
| Year of publication | 2015 |
| Journal volume | 34 |
| Journal issue | 19 |
| Pages of publication | 4700 |
| a | 16.145 ± 0.005 Å |
| b | 16.399 ± 0.005 Å |
| c | 18.23 ± 0.006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4827 ± 3 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 20 |
| Hermann-Mauguin space group symbol | C 2 2 21 |
| Hall space group symbol | C 2c 2 |
| Residual factor for all reflections | 0.0603 |
| Residual factor for significantly intense reflections | 0.0569 |
| Weighted residual factors for significantly intense reflections | 0.1509 |
| Weighted residual factors for all reflections included in the refinement | 0.1524 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.072 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 236892 (current) | 2019-11-24 | cif/ Adding structures of 4087633, 4087634, 4087635, 4087636 via cif-deposit CGI script. |
4087636.cif |
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Users of the data should acknowledge the original authors of the
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