Information card for entry 1543719

Structure parameters

• Chemical name: (4-Heptyloxy-4'-isocyano-1,1'-biphenyl)gold(I) chloride
• Formula: C20 H23 Au Cl N O
• Calculated formula: C20 H23 Au Cl N O
• Title of publication: Mesogenic gold complexes showing aggregation-induced enhancement of phosphorescence in both crystalline and liquid-crystalline phases.
• Authors of publication: Yamada, Shigeyuki; Rokusha, Yuki; Kawano, Ryo; Fujisawa, Kaori; Tsutsumi, Osamu
• Journal of publication: Faraday discussions
• Year of publication: 2017
• Journal volume: 196
• Pages of publication: 269 - 283
• a: 78.931 ± 0.009 Å
• b: 7.0341 ± 0.0008 Å
• c: 6.8739 ± 0.0008 Å
• α: 90°
• β: 91.828 ± 0.003°
• γ: 90°
• Cell volume: 3814.5 ± 0.8 ų
• Cell temperature: 296 ± 0.2 K
• Ambient diffraction temperature: 296 ± 0.2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0795
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.1402
• Weighted residual factors for all reflections included in the refinement: 0.1693
• Goodness-of-fit parameter for all reflections included in the refinement: 0.897
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No