Information card for entry 4346069

Structure parameters

• Formula: C60 H77 N4 O20.5 Pb4
• Calculated formula: C60 H76 N4 O20 Pb4
• Title of publication: Robust molecular bowl-based metal-organic frameworks with open metal sites: size modulation to increase the catalytic activity.
• Authors of publication: Liu, Lin; Han, Zheng-Bo; Wang, Shi-Ming; Yuan, Da-Qiang; Ng, Seik Weng
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 8
• Pages of publication: 3719 - 3721
• a: 20.7139 ± 0.0003 Å
• b: 20.7139 Å
• c: 8.143 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3493.88 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 104
• Hermann-Mauguin space group symbol: P 4 n c
• Hall space group symbol: P 4 -2n
• Residual factor for all reflections: 0.0311
• Residual factor for significantly intense reflections: 0.026
• Weighted residual factors for significantly intense reflections: 0.0517
• Weighted residual factors for all reflections included in the refinement: 0.0537
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No