Information card for entry 7106344

Structure parameters

• Common name: Co22(btb)12 (DUT-28(LT))
• Formula: C162 H90 Co11 O60
• Calculated formula: C162 H90 Co11 O60
• Title of publication: High-throughput discovery of porous materials
• Authors of publication: Philipp Wollmann; Matthias Leistner; Ulrich Stoeck; Ronny Grunker; Kristina Gedrich; Nicole Klein; Oliver Throl; Wulf Grahlert; Irena Senkovska; Frieder Dreisbach; Stefan Kaskel
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 5151
• a: 45.386 ± 0.009 Å
• b: 35.904 ± 0.007 Å
• c: 33.184 ± 0.007 Å
• α: 90°
• β: 94.91 ± 0.03°
• γ: 90°
• Cell volume: 53876 ± 19 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 100 K
• Ambient diffracton pressure: 100 kPa
• Number of distinct elements: 4
• 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: 0.0926
• Residual factor for significantly intense reflections: 0.0763
• Weighted residual factors for significantly intense reflections: 0.2133
• Weighted residual factors for all reflections included in the refinement: 0.2252
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.88561 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No