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Information card for entry 2233506
Preview
Coordinates | 2233506.cif |
---|---|
Structure factors | 2233506.hkl |
Original IUCr paper | HTML |
Chemical name | <i>catena</i>-Poly[copper(II)-bis(μ-2-formyl-6-methoxyphenolato- κ^4^<i>O</i>^2^,<i>O</i>^1^:<i>O</i>^1^,<i>O</i>^6^)-[(methanol- κ<i>O</i>)sodium]-μ-perchlorato-κ^2^<i>O</i>:<i>O</i>'] |
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Formula | C17 H18 Cl Cu Na O11 |
Calculated formula | C17 H18 Cl Cu Na O11 |
SMILES | c1([O]([Na]234(OCl(=O)(=O)=O)[OH]C)C)cccc5c1[O]2[Cu]1([O]=C5)[O]3c2c([O]4C)cccc2C=[O]1 |
Title of publication | <i>catena</i>-Poly[copper(II)-bis(μ-2-formyl-6-methoxyphenolato-κ^4^<i>O</i>^2^,<i>O</i>^1^:<i>O</i>^1^,<i>O</i>^6^)-[(methanol-κ<i>O</i>)sodium]-μ-perchlorato-κ^2^<i>O</i>:<i>O</i>'] |
Authors of publication | Gao, Ting; Gao, Po; Li, Hong-Feng; Zhang, Ju-Wen; Xu, Li-Li |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2012 |
Journal volume | 68 |
Journal issue | 2 |
Pages of publication | m152 |
a | 7.9552 ± 0.0016 Å |
b | 8.9453 ± 0.0018 Å |
c | 15.563 ± 0.003 Å |
α | 81.27 ± 0.03° |
β | 84.24 ± 0.03° |
γ | 68.25 ± 0.03° |
Cell volume | 1015.6 ± 0.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0401 |
Residual factor for significantly intense reflections | 0.0336 |
Weighted residual factors for significantly intense reflections | 0.0947 |
Weighted residual factors for all reflections included in the refinement | 0.1078 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.112 |
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/2233506.html
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