Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2232330
Preview
Coordinates | 2232330.cif |
---|---|
Structure factors | 2232330.hkl |
Original IUCr paper | HTML |
Chemical name | Tetra-μ-acetato-κ^8^<i>O</i>:<i>O</i>'-bis{[<i>N</i>-(4- methylphenyl)pyridin-2-amine-κ<i>N</i>^1^]copper(II)}(<i>Cu</i>—<i>Cu</i>) |
---|---|
Formula | C32 H36 Cu2 N4 O8 |
Calculated formula | C32 H36 Cu2 N4 O8 |
SMILES | C1(C)=[O][Cu]234([n]5ccccc5Nc5ccc(cc5)C)[O]=C(C)O[Cu]2(O1)([n]1ccccc1Nc1ccc(cc1)C)([O]=C(C)O3)OC(C)=[O]4 |
Title of publication | Tetra-μ-acetato-κ^8^<i>O</i>:<i>O</i>'-bis{[<i>N</i>-(4-methylphenyl)pyridin-2-amine-κ<i>N</i>^1^]copper(II)}(<i>Cu</i>—<i>Cu</i>) |
Authors of publication | Fairuz, Zainal Abidin; Aiyub, Zaharah; Abdullah, Zanariah; Ng, Seik Weng; Tiekink, Edward R. T. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2011 |
Journal volume | 67 |
Journal issue | 11 |
Pages of publication | m1636 |
a | 7.6285 ± 0.0009 Å |
b | 11.3242 ± 0.0013 Å |
c | 18.566 ± 0.002 Å |
α | 90° |
β | 95.717 ± 0.002° |
γ | 90° |
Cell volume | 1595.9 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0965 |
Residual factor for significantly intense reflections | 0.077 |
Weighted residual factors for significantly intense reflections | 0.1983 |
Weighted residual factors for all reflections included in the refinement | 0.2085 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.076 |
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/2232330.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.