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Information card for entry 7235734
Preview
| Coordinates | 7235734.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Chemical name | Zr |
|---|---|
| Formula | C49 H86 N2 O8 Zr2 |
| Calculated formula | C49 H86 N2 O8 Zr2 |
| Title of publication | Zr(iv) complexes containing salan-type ligands: synthesis, structural characterization and role as catalysts towards the polymerization of ε-caprolactone, rac-lactide, ethylene, homopolymerization and copolymerization of epoxides with CO2 |
| Authors of publication | Mandal, Mrinmay; Chakraborty, Debashis; Ramkumar, Venkatachalam |
| Journal of publication | RSC Advances |
| Year of publication | 2015 |
| Journal volume | 5 |
| Journal issue | 36 |
| Pages of publication | 28536 |
| a | 16.8978 ± 0.0005 Å |
| b | 13.4806 ± 0.0004 Å |
| c | 24.3958 ± 0.0007 Å |
| α | 90° |
| β | 102.679 ± 0.001° |
| γ | 90° |
| Cell volume | 5421.7 ± 0.3 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0615 |
| Residual factor for significantly intense reflections | 0.0473 |
| Weighted residual factors for significantly intense reflections | 0.1374 |
| Weighted residual factors for all reflections included in the refinement | 0.1613 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.853 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7235734.cif |
| 233268 | 2019-11-23 | cif/ Adding structures of 7235732, 7235733, 7235734 via cif-deposit CGI script. |
7235734.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.