Information card for entry 4127999

Structure parameters

• Formula: C117.3 H119.66 N5.06 O10.5 Zn
• Calculated formula: C117.295 H119.649 N5.059 O10.5 Zn
• Title of publication: One-Step Synthesis of an Adaptive Nanographene MOF: Adsorbed Gas-Dependent Geometrical Diversity.
• Authors of publication: Suginome, Shun; Sato, Hiroshi; Hori, Akihiro; Mishima, Akio; Harada, Yuki; Kusaka, Shinpei; Matsuda, Ryotaro; Pirillo, Jenny; Hijikata, Yuh; Aida, Takuzo
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 39
• Pages of publication: 15649 - 15655
• a: 19.039 ± 0.004 Å
• b: 19.244 ± 0.005 Å
• c: 19.579 ± 0.006 Å
• α: 74.73 ± 0.02°
• β: 71.112 ± 0.019°
• γ: 61.065 ± 0.016°
• Cell volume: 5890 ± 3 ų
• Cell temperature: 93 K
• Ambient diffraction temperature: 93 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2057
• Residual factor for significantly intense reflections: 0.1489
• Weighted residual factors for significantly intense reflections: 0.3903
• Weighted residual factors for all reflections included in the refinement: 0.4361
• Goodness-of-fit parameter for all reflections included in the refinement: 1.231
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No