Information card for entry 4113239

Structure parameters

• Common name: 1(OTf)4+4.8H2O
• Formula: C100 H72 Au4 F12 N4 O16.8 P4 S4
• Calculated formula: C100 H72 Au4 F12 N4 O16.8 P4 S4
• Title of publication: Self-Assembly and Molecular Recognition of a Luminescent Gold Rectangle
• Authors of publication: Ronger Lin; John H. K. Yip; Ke Zhang; Lip Lin Koh; Kwok-Yin Wong; Kam Piu Ho
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2004
• Journal volume: 126
• Pages of publication: 15852 - 15869
• a: 28.242 ± 0.004 Å
• b: 24.405 ± 0.004 Å
• c: 10.3082 ± 0.0016 Å
• α: 90°
• β: 96.392 ± 0.003°
• γ: 90°
• Cell volume: 7060.7 ± 1.9 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 8
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.1365
• Residual factor for significantly intense reflections: 0.0748
• Weighted residual factors for significantly intense reflections: 0.2187
• Weighted residual factors for all reflections included in the refinement: 0.2426
• Goodness-of-fit parameter for all reflections included in the refinement: 0.968
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No