Information card for entry 4124247

Structure parameters

• Formula: C54 H32 O49.44 Zr3
• Calculated formula: C54 H32 O49.4368 Zr3
• Title of publication: Piezofluorochromic Metal-Organic Framework: A Microscissor Lift.
• Authors of publication: Zhang, Qiang; Su, Jie; Feng, Dawei; Wei, Zhangwen; Zou, Xiaodong; Zhou, Hong-Cai
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2015
• Journal volume: 137
• Journal issue: 32
• Pages of publication: 10064 - 10067
• a: 50.72 ± 0.03 Å
• b: 50.72 ± 0.03 Å
• c: 15.502 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 34536 ± 3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• Space group number: 191
• Hermann-Mauguin space group symbol: P 6/m m m
• Hall space group symbol: -P 6 2
• Residual factor R(I) for significantly intense reflections: 0.00369
• Goodness-of-fit parameter for all reflections: 2.019
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 0.72959 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No