Information card for entry 1543717

Structure parameters

• Chemical name: (4-Isocyano-4'-pentyloxy-1,1'-biphenyl)gold(I) chloride
• Formula: C18 H19 Au Cl N O
• Calculated formula: C18 H19 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: 35.545 ± 0.009 Å
• b: 7.0033 ± 0.0017 Å
• c: 6.8729 ± 0.0016 Å
• α: 90°
• β: 92.118 ± 0.005°
• γ: 90°
• Cell volume: 1709.7 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• 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: 0.0777
• Residual factor for significantly intense reflections: 0.0531
• Weighted residual factors for significantly intense reflections: 0.1613
• Weighted residual factors for all reflections included in the refinement: 0.1811
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No