Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7242300
Preview
| Coordinates | 7242300.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C60 H64 N24 O5 P4 |
|---|---|
| Calculated formula | C60 H64 N24 O5 P4 |
| Title of publication | Coordination versus hydrogen bonds in the structures of different tris(pyridin-2-yl)phosphoric triamide derivatives |
| Authors of publication | Sebghati, Marjan; Tarahhomi, Atekeh; Bozorgvar, Marjan Sadat; Dumitrescu, Dan G.; van der Lee, Arie |
| Journal of publication | RSC Advances |
| Year of publication | 2021 |
| Journal volume | 11 |
| Journal issue | 14 |
| Pages of publication | 8178 - 8197 |
| a | 10.568 ± 0.002 Å |
| b | 13.475 ± 0.003 Å |
| c | 21.853 ± 0.004 Å |
| α | 90° |
| β | 92.35 ± 0.03° |
| γ | 90° |
| Cell volume | 3109.3 ± 1.1 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 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 | 0.0359 |
| Residual factor for significantly intense reflections | 0.0354 |
| Weighted residual factors for significantly intense reflections | 0.0941 |
| Weighted residual factors for all reflections included in the refinement | 0.0947 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
| Diffraction radiation wavelength | 0.7 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 262184 (current) | 2021-02-24 | cif/ Adding structures of 7242300, 7242301, 7242302, 7242303, 7242304 via cif-deposit CGI script. |
7242300.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.