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Information card for entry 2311668
Preview
| Coordinates | 2311668.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C36 H42 Eu N7 O15 P2 |
|---|---|
| Calculated formula | C36 H42 Eu N7 O15 P2 |
| Title of publication | Phosphoramides bearing isoxazole derivative: spectroscopic and structural characterization, study of hydrogen-bonding interactions and two lanthanide complexes (LnIII = Ce and Eu). |
| Authors of publication | Gholivand, Khodayar; Molaei, Foroogh; Hosseini, Mahdieh |
| Journal of publication | Acta crystallographica Section B, Structural science, crystal engineering and materials |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | Pt 2 |
| Pages of publication | 176 - 185 |
| a | 14.8395 ± 0.0005 Å |
| b | 15.8178 ± 0.0005 Å |
| c | 36.7471 ± 0.0011 Å |
| α | 90° |
| β | 96.168 ± 0.001° |
| γ | 90° |
| Cell volume | 8575.6 ± 0.5 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0397 |
| Residual factor for significantly intense reflections | 0.0287 |
| Weighted residual factors for significantly intense reflections | 0.0571 |
| Weighted residual factors for all reflections included in the refinement | 0.062 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.011 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301809 (current) | 2025-08-19 | Add cross-references to PubChem compounds in COD range 2/31/ Each referenced PubChem compound corresponds to the full crystal structure. |
2311668.cif |
| 246076 | 2019-12-26 | cif/ Adding structures of 2311666, 2311667, 2311668 via cif-deposit CGI script. |
2311668.cif |
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Users of the data should acknowledge the original authors of the
structural data.