Information card for entry 2016204

Structure parameters

• Chemical name: triaqua(18-crown-6)gadolinium(III) hexacyanochromate(III) dihydrate
• Formula: C18 H34 Cr Gd N6 O11
• Calculated formula: C18 H34 Cr Gd N6 O11
• Title of publication: Hydrated hexacyanometallate(III) salts of triaqua(18-crown-6)lanthanoid(III) and tetraaqua(18-crown-6)lanthanoid(III) cations containing nine- and ten-coordinate lanthanoids
• Authors of publication: Misra, Phalguni; Koner, Rajesh; Nayak, Malabika; Mohanta, Sasankasekhar; Low, John N.; Ferguson, George; Glidewell, Christopher
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 10
• Pages of publication: m440 - m444
• a: 11.0563 ± 0.0002 Å
• b: 11.1562 ± 0.0002 Å
• c: 14.2127 ± 0.0003 Å
• α: 68.3494 ± 0.0011°
• β: 70.0959 ± 0.0012°
• γ: 66.0299 ± 0.0012°
• Cell volume: 1450.92 ± 0.05 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0418
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.1068
• Weighted residual factors for all reflections included in the refinement: 0.1078
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes