Information card for entry 4507805

Structure parameters

• Formula: C50 H30 Cu F6 N8 O4 P
• Calculated formula: C50 H30 Cu F6 N8 O4 P
• Title of publication: Two-Dimensional and Three-Dimensional Coordination Polymers of Hexakis(4-cyanophenyl)[3]radialene: The Role of Stoichiometry and Kinetics
• Authors of publication: Hollis, Courtney A.; Batten, Stuart R.; Sumby, Christopher J.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2013
• Journal volume: 13
• Journal issue: 6
• Pages of publication: 2350
• a: 9.776 ± 0.002 Å
• b: 15.018 ± 0.003 Å
• c: 16.673 ± 0.003 Å
• α: 74.51 ± 0.03°
• β: 76.8 ± 0.03°
• γ: 78.27 ± 0.03°
• Cell volume: 2270 ± 0.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0545
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.1286
• Weighted residual factors for all reflections included in the refinement: 0.1325
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No