Information card for entry 4504932

Structure parameters

• Formula: C35 H26 N2 O4
• Calculated formula: C35 H26 N2 O4
• SMILES: c1cc(ccc1C1(c2ccccc2c2c1cccc2)c1ccc(cc1)O)O.n1(=O)ccc(cc1)c1ccn(=O)cc1
• Title of publication: Crystal Engineering Based on Polymeric Hydrogen-Bonded Supramolecules by Self-Assembling of 4,4‘-(9-Fluorenylidene)diphenol and 4,4‘-Cyclohexylidenebisphenol with Bipyridines
• Authors of publication: Zeng, Qingdao; Wu, Dongxia; Liu, Caiming; Ma, Hongwei; Lu, Jun; Xu, Shandong; Li, Yan; Wang, Chen; Bai, Chunli
• Journal of publication: Crystal Growth & Design
• Year of publication: 2005
• Journal volume: 5
• Journal issue: 3
• Pages of publication: 1041
• a: 18.988 ± 0.004 Å
• b: 13.295 ± 0.003 Å
• c: 11.009 ± 0.002 Å
• α: 90°
• β: 105.97 ± 0.03°
• γ: 90°
• Cell volume: 2671.9 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• 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: 0.0765
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.1018
• Weighted residual factors for all reflections included in the refinement: 0.1112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No