Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7249124
Preview
Coordinates | 7249124.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | Crown6RbHSeO4_H2O |
---|---|
Formula | C12 H27 O11 Rb Se |
Calculated formula | C12 H27 O11 Rb Se |
Title of publication | Effect of supramolecular complexation of alkali hydrogenselenates with crown ethers and solid-solutions with their hydrogensulfate counterparts on the solid-to-solid phase transition behaviors |
Authors of publication | Ocak, Samet; Braga, Dario; d'Agostino, Simone |
Journal of publication | CrystEngComm |
Year of publication | 2024 |
Journal volume | 26 |
Journal issue | 33 |
Pages of publication | 4525 - 4532 |
a | 22.1681 ± 0.0014 Å |
b | 9.9047 ± 0.0004 Å |
c | 20.5896 ± 0.0012 Å |
α | 90° |
β | 117.183 ± 0.008° |
γ | 90° |
Cell volume | 4021.5 ± 0.5 Å3 |
Cell temperature | 293 K |
Ambient diffraction temperature | 293 K |
Number of distinct elements | 5 |
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 | 0.1335 |
Residual factor for significantly intense reflections | 0.0502 |
Weighted residual factors for significantly intense reflections | 0.0531 |
Weighted residual factors for all reflections included in the refinement | 0.0741 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.932 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7249124.html
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.