Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2224436
Preview
Coordinates | 2224436.cif |
---|---|
Structure factors | 2224436.hkl |
Original IUCr paper | HTML |
Chemical name | [μ-Bis(diphenylarsino)methane-1:2κ^2^<i>As</i>:<i>As</i>']nonacarbonyl- 1κ^3^<i>C</i>,2κ^3^<i>C</i>,3κ^3^<i>C</i>-[tris(4-fluorophenyl)phosphine- 3κ<i>P</i>]-<i>triangulo</i>-triruthenium(0) |
---|---|
Formula | C52 H34 As2 F3 O9 P Ru3 |
Calculated formula | C52 H34 As2 F3 O9 P Ru3 |
SMILES | [Ru]12([Ru]([Ru]1([P](c1ccc(F)cc1)(c1ccc(F)cc1)c1ccc(F)cc1)(C#[O])(C#[O])C#[O])([As](C[As]2(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O] |
Title of publication | [μ-Bis(diphenylarsino)methane-1:2κ^2^<i>As</i>:<i>As</i>']nonacarbonyl-1κ^3^<i>C</i>,2κ^3^<i>C</i>,3κ^3^<i>C</i>-[tris(4-fluorophenyl)phosphine-3κ<i>P</i>]-<i>triangulo</i>-triruthenium(0) |
Authors of publication | bin Shawkataly, Omar; Khan, Imthyaz Ahmed; Yeap, Chin Sing; Fun, Hoong-Kun |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2009 |
Journal volume | 65 |
Journal issue | 12 |
Pages of publication | m1620 - m1621 |
a | 16.3071 ± 0.0002 Å |
b | 16.8142 ± 0.0002 Å |
c | 18.8085 ± 0.0002 Å |
α | 90° |
β | 98.105 ± 0.001° |
γ | 90° |
Cell volume | 5105.61 ± 0.1 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 7 |
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 | 0.077 |
Residual factor for significantly intense reflections | 0.0321 |
Weighted residual factors for significantly intense reflections | 0.0557 |
Weighted residual factors for all reflections included in the refinement | 0.0672 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.998 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2224436.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.