Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7104029
Preview
Coordinates | 7104029.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | bis(6,6'-ethynyl-4-pyridine)2,2'-bipyridyl cupper(I) tetrafluoroborate hexamer |
---|---|
Chemical name | bis(6,6'-ethynyl-4-pyridine)2,2'-bipyridyl cupper(I) tetrafluoroborate hexamer |
Formula | C30 H28 B Cu F4 N6 O2 |
Calculated formula | C24 H14 B0.663333 Cu F2.65333 N4 |
Title of publication | A novel synthetic strategy for hexanuclear supramolecular architectures |
Authors of publication | Dolomanov, Oleg V; Blake, Alexander J; Champness, Neil R; Schröder, Martin; Wilson, Claire |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2003 |
Journal issue | 6 |
Pages of publication | 682 - 683 |
a | 20.467 ± 0.002 Å |
b | 20.467 ± 0.002 Å |
c | 40.139 ± 0.006 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 14561 ± 3 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 7 |
Space group number | 148 |
Hermann-Mauguin space group symbol | R -3 :H |
Hall space group symbol | -R 3 |
Residual factor for all reflections | 0.127 |
Residual factor for significantly intense reflections | 0.0761 |
Weighted residual factors for significantly intense reflections | 0.2204 |
Weighted residual factors for all reflections included in the refinement | 0.2416 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.828 |
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/7104029.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.