Information card for entry 7211013

Structure parameters

• Formula: C24 H19 Cu2 N O10
• Calculated formula: C24 H15 Cu2 N O10
• Title of publication: Wings waving: coordinating solvent-induced structural diversity of new Cu(ii) flexible MOFs with crystal to crystal transformation and gas sorption capability
• Authors of publication: Ju, Zhanfeng; Yuan, Daqiang
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 45
• Pages of publication: 9513
• a: 10.6325 ± 0.0009 Å
• b: 10.7258 ± 0.0008 Å
• c: 18.3532 ± 0.0014 Å
• α: 76.671 ± 0.006°
• β: 86.717 ± 0.006°
• γ: 74.278 ± 0.007°
• Cell volume: 1960.4 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.1269
• Residual factor for significantly intense reflections: 0.0903
• Weighted residual factors for significantly intense reflections: 0.2137
• Weighted residual factors for all reflections included in the refinement: 0.2342
• Goodness-of-fit parameter for all reflections included in the refinement: 0.982
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No