Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4507206
Preview
Coordinates | 4507206.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C20 H26 Cu N8 O8 |
---|---|
Calculated formula | C20 H26 Cu N8 O8 |
SMILES | c1cc[nH][n]1[Cu]([n]1ccc[nH]1)([n]1ccc[nH]1)([n]1ccc[nH]1)(OC(=O)CCC(=O)O)OC(CCC(=O)O)=O |
Title of publication | Coordination Polymers Based on the Trinuclear Triangular Secondary Building Unit [Cu3(μ3-OH)(μ-pz)3]2+(pz = pyrazolate) and Succinate Anion |
Authors of publication | Di Nicola, Corrado; Forlin, Enrico; Garau, Federica; Gazzano, Massimo; Lanza, Arianna; Monari, Magda; Nestola, Fabrizio; Pandolfo, Luciano; Pettinari, Claudio; Zorzi, Alberto; Zorzi, Federico |
Journal of publication | Crystal Growth & Design |
Year of publication | 2013 |
Journal volume | 13 |
Journal issue | 1 |
Pages of publication | 126 |
a | 22.429 ± 0.0008 Å |
b | 22.429 ± 0.0008 Å |
c | 10.2923 ± 0.0007 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 5177.6 ± 0.4 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 5 |
Space group number | 88 |
Hermann-Mauguin space group symbol | I 41/a :2 |
Hall space group symbol | -I 4ad |
Residual factor for all reflections | 0.0554 |
Residual factor for significantly intense reflections | 0.0317 |
Weighted residual factors for significantly intense reflections | 0.0421 |
Weighted residual factors for all reflections included in the refinement | 0.044 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
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/4507206.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.