Information card for entry 2208902

Structure parameters

• Chemical name: Triaquatetrakis(dimethylacetamide-κO)gadolinium(III) hexacyanoferrate(III) dihydrate
• Formula: C22 H46 Fe Gd N10 O9
• Calculated formula: C22 H46 Fe Gd N10 O9
• Title of publication: Triaquatetrakis(dimethylacetamide-κ<i>O</i>)gadolinium(III) hexacyanoferrate(III) dihydrate
• Authors of publication: Svendsen, Helle; Overgaard, Jacob; Chevalier, Marie A.; Iversen, Bo B.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 5
• Pages of publication: m989 - m991
• a: 16.0883 ± 0.0003 Å
• b: 19.262 ± 0.0004 Å
• c: 22.2566 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6897.2 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0402
• Residual factor for significantly intense reflections: 0.0277
• Weighted residual factors for significantly intense reflections: 0.0675
• Weighted residual factors for all reflections included in the refinement: 0.0703
• Goodness-of-fit parameter for all reflections included in the refinement: 1.279
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes