Information card for entry 7108622

Structure parameters

• Formula: C26 H18 N2 O9 Zn
• Calculated formula: C26 H18 N2 O9 Zn
• Title of publication: Fluorescent and photochromic bifunctional molecular switch based on a stable crystalline metal-viologen complex
• Authors of publication: Yu Zeng; Shijun Liao; Jingcao Dai; Zhiyong Fu
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 11641
• a: 9.5601 ± 0.0019 Å
• b: 14.382 ± 0.003 Å
• c: 18.401 ± 0.005 Å
• α: 90°
• β: 113.56 ± 0.02°
• γ: 90°
• Cell volume: 2319.1 ± 1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0611
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.1322
• Weighted residual factors for all reflections included in the refinement: 0.1513
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No