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Information card for entry 4122357
Preview
| Coordinates | 4122357.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C88 H124 Fe2 O8 S4 Ti2 |
|---|---|
| Calculated formula | C88 H124 Fe2 O8 S4 Ti2 |
| Title of publication | Redox Control of Group 4 Metal Ring-Opening Polymerization Activity toward l-Lactide and ε-Caprolactone. |
| Authors of publication | Wang, Xinke; Thevenon, Arnaud; Brosmer, Jonathan L.; Yu, Insun; Khan, Saeed I.; Mehrkhodavandi, Parisa; Diaconescu, Paula L. |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2014 |
| Journal volume | 136 |
| Journal issue | 32 |
| Pages of publication | 11264 - 11267 |
| a | 18.444 ± 0.004 Å |
| b | 16.057 ± 0.004 Å |
| c | 29.515 ± 0.007 Å |
| α | 90° |
| β | 100.282 ± 0.003° |
| γ | 90° |
| Cell volume | 8601 ± 3 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0524 |
| Residual factor for significantly intense reflections | 0.0358 |
| Weighted residual factors for significantly intense reflections | 0.0859 |
| Weighted residual factors for all reflections included in the refinement | 0.0945 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179025 (current) | 2016-03-22 | cif/4/12/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/12/23. |
4122357.cif |
| 123044 | 2014-09-06 | cif/ Updating files of 4122357, 4122358, 4122359, 4122360 Original log message: Adding full bibliography for 4122357--4122360.cif. |
4122357.cif |
| 120952 | 2014-07-31 | cif/ Adding structures of 4122357, 4122358, 4122359, 4122360 via cif-deposit CGI script. |
4122357.cif |
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Users of the data should acknowledge the original authors of the
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