Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2103551
Preview
Coordinates | 2103551.cif |
---|---|
Original IUCr paper | HTML |
Common name | [Co(trien)(L-leu)](ClO4)2(H2O)2 |
---|---|
Chemical name | (L-leucinato)-(triethylenetetramine)-cobalt(III) diperchlorate dihydrate |
Formula | C12 H34 Cl2 Co N5 O12 |
Calculated formula | C12 H34 Cl2 Co N5 O12 |
SMILES | [Co]1234([NH2]CC[NH]1CC[NH]2CC[NH2]3)[NH2][C@H](C(=O)O4)CC(C)C.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].O.O |
Title of publication | Structures of three <i>cis</i>-β~1~ and three <i>cis</i>-β~2~ isomers of [Co(trien)(aminoacidato)]^2+^ complexes |
Authors of publication | Cai, Jiwen; Hu, Xiaopeng; Feng, Xiaolong; Ji, Liangnian; Bernal, Ivan |
Journal of publication | Acta Crystallographica Section B |
Year of publication | 2001 |
Journal volume | 57 |
Journal issue | 1 |
Pages of publication | 45 - 53 |
a | 8.7716 ± 0.0008 Å |
b | 12.6294 ± 0.0015 Å |
c | 21.413 ± 0.004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2372.1 ± 0.6 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0451 |
Residual factor for significantly intense reflections | 0.0359 |
Weighted residual factors for all reflections included in the refinement | 0.1 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.999 |
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/2103551.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.