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Information card for entry 2014814
Preview
Coordinates | 2014814.cif |
---|---|
Structure factors | 2014814.hkl |
Original IUCr paper | HTML |
Chemical name | poly[[dichlorocopper(II)]-di-μ~2~-2-propyl-2H-tetrazole-κ^2^N^1^:N^4^] |
---|---|
Formula | C8 H16 Cl2 Cu N8 |
Calculated formula | C8 H16 Cl2 Cu N8 |
SMILES | c1nn(CCC)n[n]1[Cu](Cl)([n]1cnn(CCC)n1)Cl |
Title of publication | Coordination polymers formed by bridging 2-substituted tetrazole ligands: poly[[dichlorocopper(II)]-di-μ~2~-2-propyl-2<i>H</i>-tetrazole-κ^2^<i>N</i>^1^:<i>N</i>^4^] and poly[[dichlorocopper(II)]-di-μ~2~-2-allyl-2<i>H</i>-tetrazole-κ^2^<i>N</i>^1^:<i>N</i>^4^] |
Authors of publication | Lyakhov, Alexander S.; Degtyarik, Michail M.; Ivashkevich, Ludmila S.; Gaponik, Pavel N. |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 2005 |
Journal volume | 61 |
Journal issue | 4 |
Pages of publication | m158 - m160 |
a | 9.885 ± 0.003 Å |
b | 8.867 ± 0.002 Å |
c | 17.092 ± 0.004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1498.1 ± 0.7 Å3 |
Cell temperature | 292 ± 2 K |
Ambient diffraction temperature | 292 ± 2 K |
Number of distinct elements | 5 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0434 |
Residual factor for significantly intense reflections | 0.0408 |
Weighted residual factors for significantly intense reflections | 0.1223 |
Weighted residual factors for all reflections included in the refinement | 0.1243 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.126 |
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/2014814.html
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