Information card for entry 7105168

Structure parameters

• Formula: C40 H24 N2 O10 Zn2
• Calculated formula: C40 H24 N2 O10 Zn2
• Title of publication: Stepwise and hysteretic sorption of N(2), O(2), CO(2), and H(2) gases in a porous metal-organic framework [Zn(2)(BPnDC)(2)(bpy)].
• Authors of publication: Park, Hye Jeong; Suh, Myunghyun Paik
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 4
• Pages of publication: 610 - 612
• a: 21.536 ± 0.004 Å
• b: 18.048 ± 0.004 Å
• c: 26.298 ± 0.005 Å
• α: 90°
• β: 104.55 ± 0.03°
• γ: 90°
• Cell volume: 9894 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0484
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.139
• Weighted residual factors for all reflections included in the refinement: 0.1405
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.82655 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No