Information card for entry 7231602

Structure parameters

• Formula: C29 H30 Co N2 O7.5
• Calculated formula: C29 H30 Co N2 O7.5
• Title of publication: Guest-induced reversible crystal-to-amorphous-to-crystal transformation in a Co(ii)-based metal‒organic framework
• Authors of publication: Tan, Huiling; Chen, Qibin; Sheng, Yujie; Li, Xiaoxiao; Liu, Honglai
• Journal of publication: CrystEngComm
• Year of publication: 2018
• Journal volume: 20
• Journal issue: 42
• Pages of publication: 6828
• a: 15.715 ± 0.007 Å
• b: 23.065 ± 0.009 Å
• c: 9.764 ± 0.004 Å
• α: 90°
• β: 108.308 ± 0.007°
• γ: 90°
• Cell volume: 3360 ± 2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1297
• Residual factor for significantly intense reflections: 0.0606
• Weighted residual factors for significantly intense reflections: 0.1532
• Weighted residual factors for all reflections included in the refinement: 0.1914
• Goodness-of-fit parameter for all reflections included in the refinement: 0.884
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No