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Information card for entry 4338882
Preview
Coordinates | 4338882.cif |
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Original paper (by DOI) | HTML |
Formula | Cd Hg6 I6 Sb4 |
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Calculated formula | Cd0.99 Hg6 I6 Sb4 |
Title of publication | Synthesis, crystal and band structures, and properties of a new mixed three-dimensional framework metal pnictidehalide semiconductor, (Hg6Sb4)(CdI6). |
Authors of publication | Zou, Jian-Ping; Li, Yan; Zhang, Zhang-Jing; Guo, Guo-Cong; Liu, Xi; Wang, Ming-Sheng; Cai, Li-Zhen; Lu, Ying-Bing; Huang, Jin-Shun |
Journal of publication | Inorganic chemistry |
Year of publication | 2007 |
Journal volume | 46 |
Journal issue | 18 |
Pages of publication | 7321 - 7325 |
a | 13.3818 ± 0.0009 Å |
b | 13.3818 ± 0.0009 Å |
c | 13.3818 ± 0.0009 Å |
α | 90.93° |
β | 90.93° |
γ | 90.93° |
Cell volume | 2395.4 ± 0.3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 167 |
Hermann-Mauguin space group symbol | R -3 c :R |
Hall space group symbol | -P 3* 2n |
Residual factor for all reflections | 0.1081 |
Residual factor for significantly intense reflections | 0.0655 |
Weighted residual factors for significantly intense reflections | 0.1247 |
Weighted residual factors for all reflections included in the refinement | 0.1329 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.997 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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