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Information card for entry 4336343
Preview
Coordinates | 4336343.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | Au Cs I4 O12 |
---|---|
Calculated formula | Au Cs I4 O12 |
SMILES | [I](=O)(=O)O[Au](O[I](=O)=O)(O[I](=O)=O)O[I](=O)=O.[Cs+] |
Title of publication | Explorations of a Series of Second Order Nonlinear Optical Materials Based on Monovalent Metal Gold(III) Iodates |
Authors of publication | Chao Huang; Chun-Li Hu; Xiang Xu; Bing-Ping Yang; Jiang-Gao Mao |
Journal of publication | Inorganic Chemistry |
Year of publication | 2013 |
Journal volume | 52 |
Pages of publication | 11551 - 11562 |
a | 13.7753 ± 0.0016 Å |
b | 5.5886 ± 0.0003 Å |
c | 8.4817 ± 0.0007 Å |
α | 90° |
β | 108.94 ± 0.013° |
γ | 90° |
Cell volume | 617.61 ± 0.11 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 5 |
Hermann-Mauguin space group symbol | C 1 2 1 |
Hall space group symbol | C 2y |
Residual factor for all reflections | 0.0315 |
Residual factor for significantly intense reflections | 0.0305 |
Weighted residual factors for significantly intense reflections | 0.0674 |
Weighted residual factors for all reflections included in the refinement | 0.0679 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.987 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4336343.html
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