Information card for entry 4315549

Structure parameters

• Common name: Zn4O(spiro)-LT (DUT-7(LT))
• Formula: C63 H56 N2 O15 Zn4
• Calculated formula: C63 H54 N2 O15 Zn4
• Title of publication: New Chiral and Flexible Metal-Organic Framework with a Bifunctional Spiro Linker and Zn4O-Nodes
• Authors of publication: Kristina Gedrich; Irena Senkovska; Igor A. Baburin; Uwe Mueller; Oliver Trapp; Stefan Kaskel
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 4440 - 4446
• a: 21.56 ± 0.003 Å
• b: 21.56 ± 0.003 Å
• c: 77.814 ± 0.016 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 31325 ± 9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 179
• Hermann-Mauguin space group symbol: P 65 2 2
• Hall space group symbol: P 65 2 (0 0 1)
• Residual factor for all reflections: 0.0958
• Residual factor for significantly intense reflections: 0.0551
• Weighted residual factors for significantly intense reflections: 0.1308
• Weighted residual factors for all reflections included in the refinement: 0.1443
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9
• Diffraction radiation wavelength: 0.88561 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No