Information card for entry 7240792

Structure parameters

• Formula: C165 H234 Cl18 N12 O48
• Calculated formula: C282 H324 N12 O60
• Title of publication: One-dimensional arrangement of NORIA in the solid-state
• Authors of publication: Shimoyama, Daisuke; Sekiya, Ryo; Maekawa, Hiroyuki; Kudo, Hiroto; HAINO, Takeharu
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 20.144 ± 0.005 Å
• b: 20.144 ± 0.005 Å
• c: 25.29 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 8887 ± 4 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 5
• Space group number: 176
• Hermann-Mauguin space group symbol: P 63/m
• Hall space group symbol: -P 6c
• Residual factor for all reflections: 0.2126
• Residual factor for significantly intense reflections: 0.1692
• Weighted residual factors for significantly intense reflections: 0.5562
• Weighted residual factors for all reflections included in the refinement: 0.6065
• Goodness-of-fit parameter for all reflections included in the refinement: 2.862
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No