Information card for entry 7244440

Structure parameters

• Formula: C28 H16 Au2 Cu Hg2 N12
• Calculated formula: C28 H16 Au2 Cu Hg2 N12
• Title of publication: Crystal engineering of aurophilic supramolecular architectures and coordination polymers based on butterfly-like copper–dicyanoaurate complexes: vapochromism, P–T behaviour and multi-metallic cocrystal formation
• Authors of publication: Priola, Emanuele; Curetti, Nadia; Marabello, Domenica; Andreo, Jacopo; Giordana, Alessia; Andreo, Luca; Benna, Piera; Freire, Paulo Tarso Cavalcante; Benzi, Paola; Operti, Lorenza; Diana, Eliano
• Journal of publication: CrystEngComm
• Year of publication: 2022
• Journal volume: 24
• Journal issue: 12
• Pages of publication: 2336 - 2348
• a: 7.8055 ± 0.0007 Å
• b: 18.3374 ± 0.0016 Å
• c: 22.0881 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3161.5 ± 0.5 ų
• Cell temperature: 342.9 ± 0.7 K
• Ambient diffraction temperature: 342.9 ± 0.7 K
• Number of distinct elements: 6
• Space group number: 72
• Hermann-Mauguin space group symbol: I b a m
• Hall space group symbol: -I 2 2c
• Residual factor for all reflections: 0.0592
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.0744
• Weighted residual factors for all reflections included in the refinement: 0.0818
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No