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Information card for entry 2008854
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Coordinates | 2008854.cif |
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Original IUCr paper | HTML |
Chemical name | Bis(1-methylimidazole-N^3^)bis(salicylato-O,O')copper(II) |
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Formula | C22 H22 Cu N4 O6 |
Calculated formula | C22 H22 Cu N4 O6 |
SMILES | c1cn(c[n]1[Cu]([n]1ccn(c1)C)(OC(=O)c1ccccc1O)OC(=O)c1ccccc1O)C |
Title of publication | Bis(1-methylimidazole-<i>N</i>^3^)bis(salicylato-<i>O</i>,<i>O</i>')copper(II) |
Authors of publication | Jian, Fangfang; Wang, Zuoxiang; Wei, Chen; Bai, Zhiping; You, Xiaozeng |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 1999 |
Journal volume | 55 |
Journal issue | 8 |
Pages of publication | 1228 - 1230 |
a | 7.927 ± 0.003 Å |
b | 6.159 ± 0.002 Å |
c | 22.47 ± 0.01 Å |
α | 90° |
β | 97.76 ± 0.04° |
γ | 90° |
Cell volume | 1087 ± 0.7 Å3 |
Cell temperature | 300 ± 2 K |
Ambient diffraction temperature | 300 ± 2 K |
Number of distinct elements | 5 |
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 | 0.055 |
Residual factor for significantly intense reflections | 0.041 |
Weighted residual factors for all reflections | 0.107 |
Weighted residual factors for significantly intense reflections | 0.101 |
Goodness-of-fit parameter for all reflections | 1.054 |
Goodness-of-fit parameter for significantly intense reflections | 1.143 |
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/2008854.html
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