Information card for entry 7700865

Structure parameters

• Formula: C54 H48 Ag Cl3 N4
• Calculated formula: C53 H47 Ag N4
• Title of publication: β-Arylethynyl substituted silver corrole complexes.
• Authors of publication: Stefanelli, Manuela; Ricci, Antonella; Chiarini, Marco; Lo Sterzo, Claudio; Berionni Berna, Beatrice; Pomarico, Giuseppe; Sabuzi, Federica; Galloni, Pierluca; Fronczek, Frank R.; Smith, Kevin M.; Wang, Liping; Ou, Zhongping; Kadish, Karl M.; Paolesse, Roberto
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 36
• Pages of publication: 13589 - 13598
• a: 39.1084 ± 0.0018 Å
• b: 13.0986 ± 0.0007 Å
• c: 38.0973 ± 0.0019 Å
• α: 90°
• β: 109.933 ± 0.006°
• γ: 90°
• Cell volume: 18346.8 ± 1.7 ų
• Cell temperature: 90 ± 0.5 K
• Ambient diffraction temperature: 90 ± 0.5 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.2061
• Residual factor for significantly intense reflections: 0.16
• Weighted residual factors for significantly intense reflections: 0.4069
• Weighted residual factors for all reflections included in the refinement: 0.4357
• Goodness-of-fit parameter for all reflections included in the refinement: 1.512
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No