Information card for entry 4334272

Structure parameters

• Formula: C23 H19 N4 O7 S Zn
• Calculated formula: C23 H19 N4 O7 S Zn
• 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: 7.3068 ± 0.0012 Å
• b: 12.984 ± 0.002 Å
• c: 14.251 ± 0.002 Å
• α: 77.487 ± 0.006°
• β: 77.231 ± 0.006°
• γ: 88.687 ± 0.007°
• Cell volume: 1286.8 ± 0.3 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.062
• Residual factor for significantly intense reflections: 0.0582
• Weighted residual factors for significantly intense reflections: 0.186
• Weighted residual factors for all reflections included in the refinement: 0.1897
• Goodness-of-fit parameter for all reflections included in the refinement: 1.128
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No