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Information card for entry 7703352
Preview
| Coordinates | 7703352.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C38 H47 Br2 N14 O14 Yb |
|---|---|
| Calculated formula | C38 H47 Br2 N14 O14 Yb |
| Title of publication | A designed and potentially decadentate ligand for use in lanthanide(iii) catalysed biomass transformations: targeting diastereoselective trans-4,5-diaminocyclopentenone derivatives. |
| Authors of publication | Peewasan, Krisana; Merkel, Marcel P.; Fuhr, Olaf; Powell, Annie K. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2020 |
| Journal volume | 49 |
| Journal issue | 7 |
| Pages of publication | 2331 - 2336 |
| a | 10.3185 ± 0.0003 Å |
| b | 16.0985 ± 0.0005 Å |
| c | 16.1412 ± 0.0005 Å |
| α | 118.099 ± 0.002° |
| β | 96 ± 0.002° |
| γ | 92.008 ± 0.002° |
| Cell volume | 2341.39 ± 0.13 Å3 |
| Cell temperature | 150.15 K |
| Ambient diffraction temperature | 150.15 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0639 |
| Residual factor for significantly intense reflections | 0.0601 |
| Weighted residual factors for significantly intense reflections | 0.1546 |
| Weighted residual factors for all reflections included in the refinement | 0.1604 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.066 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54186 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301878 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/70/ Each referenced PubChem compound corresponds to the full crystal structure. |
7703352.cif |
| 248961 | 2020-03-05 | cif/ Updating files of 7703352, 7703353, 7703354, 7703355 Original log message: Adding full bibliography for 7703352--7703355.cif. |
7703352.cif |
| 247237 | 2020-01-25 | cif/ Adding structures of 7703352, 7703353, 7703354, 7703355 via cif-deposit CGI script. |
7703352.cif |
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Users of the data should acknowledge the original authors of the
structural data.