Information card for entry 4315996

Structure parameters

• Formula: C48 H56 Bi6 Cl25.6 I0.4 N8 O1.5
• Calculated formula: C48 H56 Bi6 Cl25.6 I0.4 N8 O1.52
• Title of publication: Photochromism, Electrical Properties, and Structural Investigations of a Series of Hydrated Methylviologen Halobismuthate Hybrids: Influence of the Anionic Oligomer Size and Iodide Doping on the Photoinduced Properties and on the Dehydration Process
• Authors of publication: Nicolas Leblanc; Wenhua Bi; Nicolas Mercier; Pascale Auban-Senzier; Claude Pasquier
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 5824 - 5833
• a: 9.3866 ± 0.0011 Å
• b: 12.6026 ± 0.0008 Å
• c: 19.868 ± 0.002 Å
• α: 99.518 ± 0.008°
• β: 103.518 ± 0.01°
• γ: 108.027 ± 0.007°
• Cell volume: 2100 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1392
• Residual factor for significantly intense reflections: 0.0454
• Weighted residual factors for significantly intense reflections: 0.0564
• Weighted residual factors for all reflections included in the refinement: 0.0718
• Goodness-of-fit parameter for all reflections included in the refinement: 0.964
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No