Information card for entry 7214621

Structure parameters

• Formula: C36 H20 N4 Ni2 O14
• Calculated formula: C36 H20 N4 Ni2 O14
• Title of publication: A homochiral network constructed by supramolecular packing of 2D chiral bilayer: synthesis, structure and property of metal(ii) complex based on achiral 3,3′,4,4′-oxydiphthalate and coligand
• Authors of publication: Gong, Yun; Li, Jian; Qin, Jianbo; Lin, Jianhua
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 18
• Pages of publication: 5862
• a: 11.2689 ± 0.0005 Å
• b: 11.2689 ± 0.0005 Å
• c: 29.897 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3796.6 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 92
• Hermann-Mauguin space group symbol: P 41 21 2
• Hall space group symbol: P 4abw 2nw
• Residual factor for all reflections: 0.099
• Residual factor for significantly intense reflections: 0.0892
• Weighted residual factors for significantly intense reflections: 0.2414
• Weighted residual factors for all reflections included in the refinement: 0.249
• Goodness-of-fit parameter for all reflections included in the refinement: 1.108
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No