Information card for entry 7200363

Structure parameters

• Formula: C120 H132 Mn8 N24 O28
• Calculated formula: C120 H56 Mn8 N24 O28
• Title of publication: 2D Layered metal‒organic frameworks built using a hexanuclear metallamacrocycle and an octanuclear metallamacrocycle as supramolecular building blocks
• Authors of publication: Moon, Dohyun; Song, Jiheh; Lah, Myoung Soo
• Journal of publication: CrystEngComm
• Year of publication: 2009
• Journal volume: 11
• Journal issue: 5
• Pages of publication: 770
• a: 26.988 ± 0.003 Å
• b: 26.988 ± 0.003 Å
• c: 29.158 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 21237 ± 5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 130
• Hermann-Mauguin space group symbol: P 4/n c c :2
• Hall space group symbol: -P 4a 2ac
• Residual factor for all reflections: 0.1522
• Residual factor for significantly intense reflections: 0.0837
• Weighted residual factors for significantly intense reflections: 0.2243
• Weighted residual factors for all reflections included in the refinement: 0.2523
• Goodness-of-fit parameter for all reflections included in the refinement: 0.883
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No