Information card for entry 7154241

Structure parameters

• Formula: C64 H71 Au3 Cl2 N9 O15 P3
• Calculated formula: C64 H71 Au3 Cl2 N9 O15 P3
• Title of publication: A coumarin based gold(i)-alkynyl complex: a new class of supramolecular hydrogelators.
• Authors of publication: Moro, Artur J.; Rome, Bertrand; Aguiló, Elisabet; Arcau, Julià; Puttreddy, Rakesh; Rissanen, Kari; Lima, João Carlos; Rodríguez, Laura
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2015
• Journal volume: 13
• Journal issue: 7
• Pages of publication: 2026 - 2033
• a: 8.8818 ± 0.0003 Å
• b: 16.2625 ± 0.0006 Å
• c: 26.4923 ± 0.0009 Å
• α: 97.863 ± 0.003°
• β: 90.585 ± 0.003°
• γ: 105.42 ± 0.003°
• Cell volume: 3649.8 ± 0.2 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0492
• Residual factor for significantly intense reflections: 0.0415
• Weighted residual factors for significantly intense reflections: 0.11
• Weighted residual factors for all reflections included in the refinement: 0.114
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No