Information card for entry 7106706

Structure parameters

• Formula: C234 H249 Cl4 N9 Ni2 O59
• Calculated formula: C234 H208 Cl4 N9 Ni2 O59
• Title of publication: A Highly Fluorescent M2L4 Molecular Capsule with an Anthracene Shell
• Authors of publication: Zhiou Li; Norifumi Kishi; Kimiko Hasegawa; Munetaka Akita; Michito Yoshizawa
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 8605
• a: 19.4133 ± 0.0004 Å
• b: 19.4133 ± 0.0004 Å
• c: 29.968 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11294.2 ± 0.8 ų
• Cell temperature: 93 K
• Ambient diffraction temperature: 93 K
• Number of distinct elements: 6
• Space group number: 104
• Hermann-Mauguin space group symbol: P 4 n c
• Hall space group symbol: P 4 -2n
• Residual factor for significantly intense reflections: 0.0573
• Weighted residual factors for all reflections included in the refinement: 0.1606
• Goodness-of-fit parameter for all reflections included in the refinement: 0.981
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No