Information card for entry 4305123

Structure parameters

• Formula: C71.82 H14.49 Au Cu F30 N6
• Calculated formula: C71.824 H14.488 Au Cu F30 N6
• Title of publication: Heterobismetal Complexes of [26]Hexaphyrin(1.1.1.1.1.1)
• Authors of publication: Shigeki Mori; Atsuhiro Osuka
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 3937 - 3939
• a: 28.665 ± 0.005 Å
• b: 7.5735 ± 0.0019 Å
• c: 32.376 ± 0.006 Å
• α: 90°
• β: 114.843 ± 0.006°
• γ: 90°
• Cell volume: 6378 ± 2 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.0792
• Residual factor for significantly intense reflections: 0.067
• Weighted residual factors for significantly intense reflections: 0.1604
• Weighted residual factors for all reflections included in the refinement: 0.1682
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No