Information card for entry 7044235

Structure parameters

• Formula: C411 H318 Au16 Cl14 N32 P16
• Calculated formula: C411 H318 Au16 Cl14 N32 P16
• Title of publication: Polypyridyl-functionalizated alkynyl gold(I) metallaligands supported by tri- and tetradentate phosphanes
• Authors of publication: Ferrer, Montserrat; Giménez, Leticia; Gutiérrez, Albert; Lima, J. C. Carlos; Rodriguez, Laura; Martinez, Manuel; Martín, Avelino; Puttreddy, Rakesh; Rissanen, Kari
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 33.1673 ± 0.0009 Å
• b: 17.3472 ± 0.0005 Å
• c: 34.857 ± 0.0014 Å
• α: 90°
• β: 105.877 ± 0.003°
• γ: 90°
• Cell volume: 19290.2 ± 1.1 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 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: 0.125
• Residual factor for significantly intense reflections: 0.1094
• Weighted residual factors for significantly intense reflections: 0.2547
• Weighted residual factors for all reflections included in the refinement: 0.265
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No