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Information card for entry 7224698
Preview
| Coordinates | 7224698.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H17 N4 O3 P |
|---|---|
| Calculated formula | C24 H17 N4 O3 P |
| SMILES | P(=Nc1ccc(N(=O)=O)c2nonc12)(c1ccccc1)(c1ccccc1)c1ccccc1 |
| Title of publication | Synthesis in Living Cells with the Assistance of Supramolecular Nanocarriers |
| Authors of publication | Shaban Ragab, Sherif; Thapaliya, Ek Raj; Zhang, Yang; Tang, Sicheng; McMahan, Jeffrey Blye; Syed, Sheyum; Captain, Burjor; Raymo, Francisco M. |
| Journal of publication | RSC Adv. |
| Year of publication | 2016 |
| a | 11.913 ± 0.0005 Å |
| b | 8.4877 ± 0.0003 Å |
| c | 21.1543 ± 0.0009 Å |
| α | 90° |
| β | 104.391 ± 0.001° |
| γ | 90° |
| Cell volume | 2071.88 ± 0.14 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/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0487 |
| Residual factor for significantly intense reflections | 0.0391 |
| Weighted residual factors for significantly intense reflections | 0.1078 |
| Weighted residual factors for all reflections included in the refinement | 0.1153 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179298 (current) | 2016-03-23 | cif/ Adding structures of 7224698 via cif-deposit CGI script. |
7224698.cif |
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Users of the data should acknowledge the original authors of the
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