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Information card for entry 2208333
Preview
Coordinates | 2208333.cif |
---|---|
Structure factors | 2208333.hkl |
Original IUCr paper | HTML |
Common name | GB377 |
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Chemical name | Tetrakis(μ~2~-2,2-dimethylpropanoato-κ^2^O,O')bis[(pyridine-κN)copper(II)] |
Formula | C30 H46 Cu2 N2 O8 |
Calculated formula | C30 H46 Cu2 N2 O8 |
SMILES | C(C1=[O][Cu]234([n]5ccccc5)[O]=C(C(C)(C)C)O[Cu]4([n]4ccccc4)([O]=C(O3)C(C)(C)C)([O]=C(C(C)(C)C)O2)O1)(C)(C)C |
Title of publication | Tetrakis(μ~2~-2,2-dimethylpropanoato-κ^2^<i>O</i>,<i>O</i>')bis[(pyridine-κ<i>N</i>)copper(II)] |
Authors of publication | Blewett, Gavin; Esterhuysen, Catharine; Bredenkamp, Martin W.; Koch, Klaus R. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2006 |
Journal volume | 62 |
Journal issue | 3 |
Pages of publication | m420 - m422 |
a | 9.7378 ± 0.0019 Å |
b | 10.0428 ± 0.0019 Å |
c | 10.435 ± 0.002 Å |
α | 61.52 ± 0.003° |
β | 72.495 ± 0.003° |
γ | 84.2 ± 0.003° |
Cell volume | 854.4 ± 0.3 Å3 |
Cell temperature | 273 ± 2 K |
Ambient diffraction temperature | 100 ± 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 | 0.0624 |
Residual factor for significantly intense reflections | 0.0455 |
Weighted residual factors for significantly intense reflections | 0.0991 |
Weighted residual factors for all reflections included in the refinement | 0.1032 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.978 |
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/2208333.html
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