Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7706695
Preview
Coordinates | 7706695.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | SN-XY-100 |
---|---|
Formula | C16 H26 N2 O5 Ru |
Calculated formula | C16 H26 N2 O5 Ru |
Title of publication | A simple synthesis of [RuCl<sub>2</sub>(NHC)(p-cymene)] complexes and their use in olefin oxidation catalysis. |
Authors of publication | Ma, Xinyuan; Guillet, Sébastien G; Peng, Min; Van Hecke, Kristof; Nolan, Steven P. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2021 |
Journal volume | 50 |
Journal issue | 11 |
Pages of publication | 3959 - 3965 |
a | 11.4295 ± 0.0002 Å |
b | 10.489 ± 0.0001 Å |
c | 15.6396 ± 0.0002 Å |
α | 90° |
β | 104.061 ± 0.001° |
γ | 90° |
Cell volume | 1818.76 ± 0.04 Å3 |
Cell temperature | 100.28 ± 0.16 K |
Ambient diffraction temperature | 100.28 ± 0.16 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0309 |
Residual factor for significantly intense reflections | 0.0248 |
Weighted residual factors for significantly intense reflections | 0.0576 |
Weighted residual factors for all reflections included in the refinement | 0.0605 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.028 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
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/7706695.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.