Information card for entry 4133878

Structure parameters

• Formula: C53 H55 Au N2
• Calculated formula: C53 H55 Au N2
• Title of publication: Isomeric Tetradentate Ligand-Containing Cyclometalated Gold(III) Complexes
• Authors of publication: Lee, Chin-Ho; Tang, Man-Chung; Kong, Fred Ka-Wai; Cheung, Wai-Lung; Ng, Maggie; Chan, Mei-Yee; Yam, Vivian Wing-Wah
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• a: 21.975 ± 0.004 Å
• b: 22.822 ± 0.005 Å
• c: 50.375 ± 0.01 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 25264 ± 9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0549
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for significantly intense reflections: 0.1133
• Weighted residual factors for all reflections included in the refinement: 0.1209
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.82653 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No