Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7134781
Preview
Coordinates | 7134781.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C62.5 H80 N2 O |
---|---|
Calculated formula | C62.5 H80 N2 O |
Title of publication | Unsymmetrical Bis(anilido)xanthene Ligands: Development and Use in the Preparation of Magnesium Diamide Complexes |
Authors of publication | Evans, Matthew J.; Jones, Cameron |
Journal of publication | Chemical Communications |
Year of publication | 2025 |
a | 12.4386 ± 0.0001 Å |
b | 19.1066 ± 0.0002 Å |
c | 21.5188 ± 0.0003 Å |
α | 89.669 ± 0.001° |
β | 87.336 ± 0.001° |
γ | 89.355 ± 0.001° |
Cell volume | 5108.22 ± 0.1 Å3 |
Cell temperature | 123.01 ± 0.1 K |
Ambient diffraction temperature | 123.01 ± 0.1 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0716 |
Residual factor for significantly intense reflections | 0.0639 |
Weighted residual factors for significantly intense reflections | 0.1845 |
Weighted residual factors for all reflections included in the refinement | 0.1945 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.068 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
300289 (current) | 2025-07-03 | cif/ Adding structures of 7134774, 7134775, 7134776, 7134777, 7134778, 7134779, 7134780, 7134781 via cif-deposit CGI script. |
7134781.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.