Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2224527
Preview
Coordinates | 2224527.cif |
---|---|
Structure factors | 2224527.hkl |
Original IUCr paper | HTML |
Chemical name | Tetra-μ-acetato-κ^8^<i>O</i>:<i>O</i>'-bis{[2-(<i>m</i>-tolylamino)pyridine- κ<i>N</i>]copper(II)} |
---|---|
Formula | C32 H36 Cu2 N4 O8 |
Calculated formula | C32 H36 Cu2 N4 O8 |
SMILES | C1(C)=[O][Cu]234([n]5ccccc5Nc5cc(ccc5)C)[O]=C(C)O[Cu]4(O1)([n]1ccccc1Nc1cc(ccc1)C)([O]=C(C)O2)[O]=C(C)O3 |
Title of publication | Tetra-μ-acetato-κ^8^<i>O</i>:<i>O</i>'-bis{[2-(<i>m</i>-tolylamino)pyridine-κ<i>N</i>]copper(II)} |
Authors of publication | Fairuz, Zainal Abidin; Aiyub, Zaharah; Abdullah, Zanariah; Ng, Seik Weng |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2009 |
Journal volume | 65 |
Journal issue | 12 |
Pages of publication | m1690 |
a | 7.7143 ± 0.0002 Å |
b | 10.5625 ± 0.0003 Å |
c | 11.2413 ± 0.0003 Å |
α | 66.531 ± 0.002° |
β | 85.74 ± 0.002° |
γ | 78.568 ± 0.002° |
Cell volume | 823.51 ± 0.04 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0557 |
Residual factor for significantly intense reflections | 0.0377 |
Weighted residual factors for significantly intense reflections | 0.0894 |
Weighted residual factors for all reflections included in the refinement | 0.0976 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.068 |
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/2224527.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.