Information card for entry 1508065

Structure parameters

• Formula: C46 H16 F8 N10 Zn
• Calculated formula: C46 H16 F8 N10 Zn
• Title of publication: Selective sorption of oxygen and nitric oxide by an electron-donating flexible porous coordination polymer.
• Authors of publication: Shimomura, Satoru; Higuchi, Masakazu; Matsuda, Ryotaro; Yoneda, Ko; Hijikata, Yuh; Kubota, Yoshiki; Mita, Yoshimi; Kim, Jungeun; Takata, Masaki; Kitagawa, Susumu
• Journal of publication: Nature chemistry
• Year of publication: 2010
• Journal volume: 2
• Journal issue: 8
• Pages of publication: 633 - 637
• a: 22.857 ± 0.006 Å
• b: 12.614 ± 0.003 Å
• c: 14.604 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4210.6 ± 1.9 ų
• Cell temperature: 223.1 K
• Ambient diffraction temperature: 223.1 K
• Number of distinct elements: 5
• Space group number: 54
• Hermann-Mauguin space group symbol: P c c a
• Hall space group symbol: -P 2a 2ac
• Residual factor for significantly intense reflections: 0.0678
• Weighted residual factors for all reflections included in the refinement: 0.0832
• Goodness-of-fit parameter for all reflections included in the refinement: 0.927
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No