Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2203807
Preview
Coordinates | 2203807.cif |
---|---|
Structure factors | 2203807.hkl |
Original IUCr paper | HTML |
Chemical name | Di-μ-acetato-μ-hydroxo-bis{acetato[bis(2-pyridyl)amine]cobalt(II)} acetate tetrahydrate |
---|---|
Formula | C28 H40 Co2 N6 O14 |
Calculated formula | C28 H40 Co2 N6 O14 |
SMILES | [Co]123([OH][Co]4([n]5ccccc5Nc5[n]4cccc5)([OH]2)(OC(=[O]3)C)OC(=O)C)([n]2ccccc2Nc2[n]1cccc2)OC(=O)C.C(=O)(C)[O-].O.O.O.O |
Title of publication | μ-Acetato-di-μ-hydroxo-bis{acetato[bis(2-pyridyl)amine]cobalt(III)} acetate tetrahydrate: a novel mixed-bridged dinuclear Co^III^ complex with bis(2-pyridyl)amine as terminal ligands |
Authors of publication | Miao Du; Xiao-Jun Zhao |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2004 |
Journal volume | 60 |
Journal issue | 6 |
Pages of publication | m785 - m787 |
a | 11.285 ± 0.003 Å |
b | 11.862 ± 0.003 Å |
c | 16.449 ± 0.004 Å |
α | 80.97 ± 0.004° |
β | 71.818 ± 0.004° |
γ | 62.518 ± 0.004° |
Cell volume | 1855.7 ± 0.8 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 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 | 0.0809 |
Residual factor for significantly intense reflections | 0.0482 |
Weighted residual factors for significantly intense reflections | 0.1239 |
Weighted residual factors for all reflections included in the refinement | 0.1418 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.004 |
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/2203807.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.