Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4069041
Preview
Coordinates | 4069041.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C52 H41 B2 Cl2 F24 N O2 Ru |
---|---|
Calculated formula | C52 H41 B2 Cl2 F24 N O2 Ru |
Title of publication | Half-Sandwich Group 8 Borylene Complexes: Synthetic and Structural Studies and Oxygen Atom Abstraction Chemistry |
Authors of publication | Pierce, Glesni A.; Vidovic, Dragoslav; Kays, Deborah L.; Coombs, Natalie D.; Thompson, Amber L.; Jemmis, Eluvathingal D.; De, Susmita; Aldridge, Simon |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 10 |
Pages of publication | 2947 |
a | 12.7397 ± 0.0002 Å |
b | 14.706 ± 0.0003 Å |
c | 16.4103 ± 0.0003 Å |
α | 77.1667 ± 0.0009° |
β | 74.0805 ± 0.0009° |
γ | 74.4248 ± 0.0008° |
Cell volume | 2811.17 ± 0.09 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 K |
Number of distinct elements | 8 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1233 |
Residual factor for significantly intense reflections | 0.0769 |
Weighted residual factors for all reflections | 0.1068 |
Weighted residual factors for significantly intense reflections | 0.0774 |
Weighted residual factors for all reflections included in the refinement | 0.0774 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.1384 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4069041.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.