Information card for entry 4128000

Structure parameters

• Formula: C97 H73 N O7 Zn
• Calculated formula: C97 H73 N O7 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: 14.057 ± 0.008 Å
• b: 16.947 ± 0.009 Å
• c: 20.427 ± 0.011 Å
• α: 73.98 ± 0.04°
• β: 74.49 ± 0.04°
• γ: 80.6 ± 0.05°
• Cell volume: 4486 ± 4 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: 0.2365
• Residual factor for significantly intense reflections: 0.1741
• Weighted residual factors for significantly intense reflections: 0.4121
• Weighted residual factors for all reflections included in the refinement: 0.4674
• Goodness-of-fit parameter for all reflections included in the refinement: 1.228
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No