Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7000593
Preview
Coordinates | 7000593.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | bis(μ~2~-1,2-bis(Diphenylphosphino)ethyne)- bis(η^5^-indenyl)-di-rodium |
---|---|
Formula | C70 H54 P4 Rh2 |
Calculated formula | C70 H54 P4 Rh2 |
SMILES | [Rh]12345([P](c6ccccc6)(c6ccccc6)C#C[P]([Rh]6789([P](c%10ccccc%10)(c%10ccccc%10)C#C[P]1(c1ccccc1)c1ccccc1)[cH]1[cH]6[cH]7[c]68cccc[c]916)(c1ccccc1)c1ccccc1)[cH]1[cH]2[cH]3[c]24[c]51cccc2 |
Title of publication | Synthesis and structure of indenyl rhodium(I) complexes containing unsaturated phosphines: catalyst precursors for alkene hydroboration |
Authors of publication | Garon, Christian N.; McIsaac, Daniel I.; Vogels, Christopher M.; Decken, Andreas; Williams, Ian D.; Kleeberg, Christian; Marder, Todd B.; Westcott, Stephen A. |
Journal of publication | Dalton Transactions |
Year of publication | 2009 |
Journal issue | 9 |
Pages of publication | 1624 - 1631 |
a | 11.6644 ± 0.0002 Å |
b | 13.4814 ± 0.0002 Å |
c | 19.1415 ± 0.0003 Å |
α | 102.098 ± 0.0005° |
β | 92.97 ± 0.0006° |
γ | 106.469 ± 0.0005° |
Cell volume | 2802.52 ± 0.08 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0406 |
Residual factor for significantly intense reflections | 0.0297 |
Weighted residual factors for significantly intense reflections | 0.0698 |
Weighted residual factors for all reflections included in the refinement | 0.0757 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
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/7000593.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.