Information card for entry 4335819

Structure parameters

• Formula: C60 H48 N12 O16 S4 Zn4
• Calculated formula: C60 H48 N12 O16 S4 Zn4
• Title of publication: Hierarchical Guest Exchange and Step-by-Step Activation of a Biporous Coordination Framework
• Authors of publication: Sergey A. Sapchenko; Denis G. Samsonenko; Danil N. Dybtsev; Vladimir P. Fedin
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 9702 - 9704
• a: 25.0401 ± 0.0005 Å
• b: 31.2285 ± 0.0005 Å
• c: 12.3111 ± 0.0002 Å
• α: 90°
• β: 98.206 ± 0.001°
• γ: 90°
• Cell volume: 9528.3 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0722
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.1018
• Weighted residual factors for all reflections included in the refinement: 0.1091
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No