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Information card for entry 7222408
Preview
| Coordinates | 7222408.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H48 Cu N8 O11 |
|---|---|
| Calculated formula | C29 H25 Cu N5 O7 |
| Title of publication | Amide Functionalized Metal Organic Frameworks for Diastereoselective Nitroaldol (Henry) Reaction in Aqueous Medium |
| Authors of publication | Paul, Anup; Karmakar, Anirban; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L. |
| Journal of publication | RSC Adv. |
| Year of publication | 2015 |
| a | 8.3259 ± 0.0014 Å |
| b | 22.773 ± 0.004 Å |
| c | 20.105 ± 0.003 Å |
| α | 90° |
| β | 93.7 ± 0.005° |
| γ | 90° |
| Cell volume | 3804.1 ± 1.1 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.1243 |
| Residual factor for significantly intense reflections | 0.0834 |
| Weighted residual factors for significantly intense reflections | 0.211 |
| Weighted residual factors for all reflections included in the refinement | 0.2268 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.057 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 159570 (current) | 2015-10-03 | cif/ Adding structures of 7222407, 7222408 via cif-deposit CGI script. |
7222408.cif |
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Users of the data should acknowledge the original authors of the
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