Information card for entry 7201901

Structure parameters

• Formula: C36 H27 Cu N9 O11
• Calculated formula: C36 H25 Cu N9 O11
• Title of publication: Supramolecular frameworks assembled via intermolecular lone pair-aromatic interaction between carbonyl and pyridyl groups
• Authors of publication: Wan, Chong-Qing; Chen, Xu-Dong; Mak, Thomas C. W.
• Journal of publication: CrystEngComm
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 5
• Pages of publication: 475
• a: 9.154 ± 0.005 Å
• b: 21.374 ± 0.011 Å
• c: 18.717 ± 0.01 Å
• α: 90°
• β: 90.286 ± 0.011°
• γ: 90°
• Cell volume: 3662 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1034
• Residual factor for significantly intense reflections: 0.0565
• Weighted residual factors for significantly intense reflections: 0.1782
• Weighted residual factors for all reflections included in the refinement: 0.2226
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No