Information card for entry 4334273

Structure parameters

• Formula: C38 H24 N2 O12 S2 Zn2
• Calculated formula: C38 H24 N2 O12 S2 Zn2
• Title of publication: Pore Design of Two-Dimensional Coordination Polymers toward Selective Adsorption
• Authors of publication: Yuh Hijikata; Satoshi Horike; Masayuki Sugimoto; Munehiro Inukai; Tomohiro Fukushima; Susumu Kitagawa
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 3634 - 3642
• a: 28.271 ± 0.006 Å
• b: 22.155 ± 0.004 Å
• c: 12.549 ± 0.003 Å
• α: 90°
• β: 104.764 ± 0.002°
• γ: 90°
• Cell volume: 7600 ± 3 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 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: 0.0854
• Residual factor for significantly intense reflections: 0.0692
• Weighted residual factors for significantly intense reflections: 0.2479
• Weighted residual factors for all reflections included in the refinement: 0.2585
• Goodness-of-fit parameter for all reflections included in the refinement: 1.699
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No