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Information card for entry 4087633
Preview
| Coordinates | 4087633.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C80 H104 Cl2 Fe2 O4 S4 Y2 |
|---|---|
| Calculated formula | C80 H104 Cl2 Fe2 O4 S4 Y2 |
| 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 | 18.289 ± 0.005 Å |
| b | 15.117 ± 0.004 Å |
| c | 33.538 ± 0.01 Å |
| α | 90° |
| β | 101.814 ± 0.003° |
| γ | 90° |
| Cell volume | 9076 ± 4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 13 |
| Hermann-Mauguin space group symbol | P 1 2/c 1 |
| Hall space group symbol | -P 2yc |
| Residual factor for all reflections | 0.0671 |
| Residual factor for significantly intense reflections | 0.046 |
| Weighted residual factors for significantly intense reflections | 0.1179 |
| Weighted residual factors for all reflections included in the refinement | 0.1258 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
| 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. |
4087633.cif |
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Users of the data should acknowledge the original authors of the
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