Information card for entry 7233136

Structure parameters

• Formula: C38 H43.87 N2 O8 Zn2
• Calculated formula: C38 H43.87 N2 O8 Zn2
• Title of publication: Self-assembly of bis-β-diketone-based [M2L2] dinuclear platforms into 2-dimensional coordination polymers
• Authors of publication: Brock, A. J.; McMurtrie, John C.; Clegg, J. K.
• Journal of publication: CrystEngComm
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 32
• Pages of publication: 4786
• a: 16.584 ± 0.003 Å
• b: 11.077 ± 0.002 Å
• c: 12.668 ± 0.003 Å
• α: 90°
• β: 107.26 ± 0.03°
• γ: 90°
• Cell volume: 2222.3 ± 0.9 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1072
• Residual factor for significantly intense reflections: 0.0851
• Weighted residual factors for significantly intense reflections: 0.1892
• Weighted residual factors for all reflections included in the refinement: 0.2078
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.7108 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No