Information card for entry 7207905

Structure parameters

• Formula: C37 H28 Cu4 O24
• Calculated formula: C37 H28 Cu4 O24
• Title of publication: A robust microporous metal‒organic framework constructed from a flexible organic linker for acetylene storage at ambient temperature
• Authors of publication: Xue, Yun-Shan; He, Yabing; Ren, Shi-Bin; Yue, Yanfeng; Zhou, Le; Li, Yi-Zhi; Du, Hong-Bin; You, Xiao-Zeng; Chen, Banglin
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2012
• Journal volume: 22
• Journal issue: 20
• Pages of publication: 10195
• a: 12.1 ± 0.003 Å
• b: 26.162 ± 0.004 Å
• c: 26.162 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8282 ± 3 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 4
• Space group number: 57
• Hermann-Mauguin space group symbol: P b c m
• Hall space group symbol: -P 2c 2b
• Residual factor for all reflections: 0.0627
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.1129
• Weighted residual factors for all reflections included in the refinement: 0.12
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No