Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1574578
Preview
Coordinates | 1574578.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C33 H25 Cl F3 N O3 P Rh S |
---|---|
Calculated formula | C33 H25 Cl F3 N O3 P Rh S |
Title of publication | L/Z-ligand type amphoterism of an acridinium unit |
Authors of publication | Litle, Elishua D.; Bedajna, Shantabh; Gabbaï, François P. |
Journal of publication | Chemical Science |
Year of publication | 2025 |
a | 27.264 ± 0.004 Å |
b | 9.5891 ± 0.0014 Å |
c | 22.664 ± 0.003 Å |
α | 90° |
β | 93.997 ± 0.006° |
γ | 90° |
Cell volume | 5910.8 ± 1.5 Å3 |
Cell temperature | 110 K |
Ambient diffraction temperature | 110 K |
Number of distinct elements | 9 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0704 |
Residual factor for significantly intense reflections | 0.0629 |
Weighted residual factors for significantly intense reflections | 0.1624 |
Weighted residual factors for all reflections included in the refinement | 0.1687 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.157 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
299537 (current) | 2025-05-06 | cif/ Adding structures of 1574577, 1574578, 1574579 via cif-deposit CGI script. |
1574578.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.