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Information card for entry 2217970
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Coordinates | 2217970.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | Tetraaquabis(1-hydroxy-2-naphthoato-κO^2^)magnesium(II) |
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Formula | C22 H22 Mg O10 |
Calculated formula | C22 H22 Mg O10 |
SMILES | C(=O)(c1c(c2ccccc2cc1)O)O[Mg]([OH2])([OH2])(OC(=O)c1c(c2ccccc2cc1)O)([OH2])[OH2] |
Title of publication | Tetraaquabis(1-hydroxy-2-naphthoato-κ<i>O</i>^2^)magnesium(II) |
Authors of publication | Huang, Fu; Song, Wen-Dong |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2008 |
Journal volume | 64 |
Journal issue | 4 |
Pages of publication | m552 |
a | 6.7462 ± 0.0005 Å |
b | 5.2285 ± 0.0004 Å |
c | 29.965 ± 0.002 Å |
α | 90° |
β | 94.28 ± 0.005° |
γ | 90° |
Cell volume | 1053.99 ± 0.13 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.07 |
Residual factor for significantly intense reflections | 0.0464 |
Weighted residual factors for significantly intense reflections | 0.1223 |
Weighted residual factors for all reflections included in the refinement | 0.1346 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.065 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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