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Information card for entry 4346732
Preview
| Coordinates | 4346732.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C42 H44 N6 Zn2 |
|---|---|
| Calculated formula | C42 H44 N6 Zn2 |
| Title of publication | Macrocyclic Dizinc(II) Alkyl and Alkoxide Complexes: Reversible CO2 Uptake and Polymerization Catalysis Testing. |
| Authors of publication | Romain, Charles; Bennington, Michael S.; White, Andrew J. P.; Williams, Charlotte K.; Brooker, Sally |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2015 |
| Journal volume | 54 |
| Journal issue | 24 |
| Pages of publication | 11842 - 11851 |
| a | 10.8554 ± 0.0004 Å |
| b | 11.4026 ± 0.0005 Å |
| c | 15.34 ± 0.0006 Å |
| α | 95.001 ± 0.003° |
| β | 104.463 ± 0.003° |
| γ | 93.974 ± 0.003° |
| Cell volume | 1823.43 ± 0.13 Å3 |
| Cell temperature | 173 K |
| Ambient diffraction temperature | 173 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0412 |
| Residual factor for significantly intense reflections | 0.0347 |
| Weighted residual factors for significantly intense reflections | 0.0932 |
| Weighted residual factors for all reflections included in the refinement | 0.0993 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 231942 (current) | 2019-11-23 | cif/ Adding structures of 4346732, 4346733, 4346734 via cif-deposit CGI script. |
4346732.cif |
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Users of the data should acknowledge the original authors of the
structural data.