Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4312903
Preview
Coordinates | 4312903.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | trans-[Ru(II)(NH3)4Cl(SO2)]Cl |
---|---|
Chemical name | trans-Tetraamminechloro(sulfur dioxide)ruthenium(II) chloride |
Formula | Cl2 H12 N4 O2 Ru S |
Calculated formula | Cl2 H12 N4 O2 Ru S |
SMILES | [NH3][Ru]([S](=O)=O)([NH3])([NH3])([NH3])Cl.[Cl-] |
Title of publication | Light-Induced Metastable Linkage Isomers of Ruthenium Sulfur Dioxide Complexes |
Authors of publication | Andrey Yu. Kovalevsky; Kimberly A. Bagley; Jacqueline M. Cole; Philip Coppens |
Journal of publication | Inorganic Chemistry |
Year of publication | 2003 |
Journal volume | 42 |
Pages of publication | 140 - 147 |
a | 13.9352 ± 0.0007 Å |
b | 7.2825 ± 0.0004 Å |
c | 9.2851 ± 0.0005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 942.28 ± 0.09 Å3 |
Cell temperature | 100 ± 1 K |
Ambient diffraction temperature | 100 ± 1 K |
Number of distinct elements | 6 |
Space group number | 62 |
Hermann-Mauguin space group symbol | P n m a |
Hall space group symbol | -P 2ac 2n |
Residual factor for all reflections | 0.0309 |
Residual factor for significantly intense reflections | 0.0286 |
Weighted residual factors for significantly intense reflections | 0.0748 |
Weighted residual factors for all reflections included in the refinement | 0.076 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.08 |
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/4312903.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.