Information card for entry 1571452

Structure parameters

• Formula: C54.67 H68.67 N4 Ni O6.67
• Calculated formula: C54.6667 H68.6667 N4 Ni O6.66667
• Title of publication: Norcorroles as antiaromatic π-electronic systems that form dimension-controlled assemblies.
• Authors of publication: Ishikawa, Soh; Yamasumi, Kazuhisa; Sugiura, Shinya; Sato, Shunsuke; Watanabe, Go; Koo, Yun Hee; Seki, Shu; Bando, Yuya; Haketa, Yohei; Shinokubo, Hiroshi; Maeda, Hiromitsu
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 20
• Pages of publication: 7603 - 7609
• a: 13.0251 ± 0.0004 Å
• b: 13.0786 ± 0.0004 Å
• c: 22.9482 ± 0.0009 Å
• α: 95.536 ± 0.002°
• β: 105.627 ± 0.002°
• γ: 95.81 ± 0.003°
• Cell volume: 3714 ± 0.2 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1214
• Residual factor for significantly intense reflections: 0.0875
• Weighted residual factors for significantly intense reflections: 0.2344
• Weighted residual factors for all reflections included in the refinement: 0.2634
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.81082 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No