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Information card for entry 2018643
Preview
Coordinates | 2018643.cif |
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Structure factors | 2018643.hkl |
Original IUCr paper | HTML |
Chemical name | di-μ~3~-ethanolato-diethyltetrakis(μ~2~-2-methyl-4-oxo-4<i>H</i>-pyran-3- olato-κ^3^<i>O</i>^3^,<i>O</i>^4^:<i>O</i>^3^)tetrazinc(II) |
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Formula | C32 H40 O14 Zn4 |
Calculated formula | C32 H40 O14 Zn4 |
Title of publication | Two tetranuclear zinc clusters, [Zn~4~(μ~3~-OEt)~2~(μ~2~-MalO)~4~Et~2~] and [Zn~4~(μ~3~-GueO)~2~(μ~2~-GueO)~2~(μ~2~-MalO)~2~(MalO)~2~]·2C~7~H~8~, containing defective dicubane core geometries (MalOH is maltol and GueOH is guethol) |
Authors of publication | Petrus, Rafał; Sobota, Piotr |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 2012 |
Journal volume | 68 |
Journal issue | 10 |
Pages of publication | m275 - m280 |
a | 9.851 ± 0.002 Å |
b | 18.828 ± 0.002 Å |
c | 10.721 ± 0.003 Å |
α | 90° |
β | 115.26 ± 0.02° |
γ | 90° |
Cell volume | 1798.3 ± 0.7 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0479 |
Residual factor for significantly intense reflections | 0.0358 |
Weighted residual factors for significantly intense reflections | 0.0937 |
Weighted residual factors for all reflections included in the refinement | 0.0975 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2018643.html
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Users of the data should acknowledge the original authors of the
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