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Information card for entry 4324722
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Coordinates | 4324722.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | Ba2 Fe S5 Sb |
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Calculated formula | Ba2 Fe S5 Sb |
SMILES | [Fe]1([S-])(S[Sb]([S-])S1)[S-].[Ba+2].[Ba+2] |
Title of publication | Syntheses, Crystal and Electronic Structures, and Characterizations of Quaternary Antiferromagnetic Sulfides: Ba2MFeS5 (M = Sb, Bi) |
Authors of publication | Lei Geng; Wen-Dan Cheng; Hao Zhang; Chen-Sheng Lin; Wei-Long Zhang; Ye-Yu Li; Zhang-Zhen He |
Journal of publication | Inorganic Chemistry |
Year of publication | 2011 |
Journal volume | 50 |
Pages of publication | 2378 - 2384 |
a | 12.128 ± 0.006 Å |
b | 8.852 ± 0.004 Å |
c | 8.917 ± 0.004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 957.3 ± 0.8 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 62 |
Hermann-Mauguin space group symbol | P n m a |
Hall space group symbol | -P 2ac 2n |
Residual factor for all reflections | 0.0233 |
Residual factor for significantly intense reflections | 0.0214 |
Weighted residual factors for significantly intense reflections | 0.0537 |
Weighted residual factors for all reflections included in the refinement | 0.0673 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.222 |
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/4324722.html
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