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Information card for entry 7008171
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Coordinates | 7008171.cif |
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Original paper (by DOI) | HTML |
Common name | (Diaquo-hexaoxalato-tetrabarium(ii)-hexakis(hexa-mu3- hydroxohexairon(ii))) diiodide tetrahydrate |
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Chemical name | [Diaquo-hexaoxalato-tetrabarium(II)-hexakis(hexa-μ3-hydroxohexairon(II))] diiodide tetrahydrate |
Formula | C12 H18 Ba4 Fe6 I2 O36 |
Calculated formula | C12 H14.04 Ba4 Fe6 I1.98 O36.02 |
Title of publication | Crystal structure and magnetic properties of a pseudo-cubic close-packed array of oxalate linked {FeII6(mu3-OH)6}6+ clusters. |
Authors of publication | Fei, Bao-Li; Clérac, Rodolphe; Anson, Christopher E.; Powell, Annie K. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2005 |
Journal issue | 8 |
Pages of publication | 1381 - 1386 |
a | 11.1999 ± 0.0012 Å |
b | 11.1999 ± 0.0012 Å |
c | 27.428 ± 0.003 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 2979.6 ± 0.6 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 6 |
Space group number | 166 |
Hermann-Mauguin space group symbol | R -3 m :H |
Hall space group symbol | -R 3 2" |
Residual factor for all reflections | 0.0669 |
Residual factor for significantly intense reflections | 0.0642 |
Weighted residual factors for significantly intense reflections | 0.1607 |
Weighted residual factors for all reflections included in the refinement | 0.1642 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
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/7008171.html
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