Information card for entry 4038946

Structure parameters

• Chemical name: 6,6',6'',6'''-[6,12-dihydroindeno[1,2-b]fluorene -6,6,12,12-tetrayltetrakis(4,1-phenylene)] tetrakis(1,3,5-triazine-2,4-diamine) 1,4-dioxane solvate dimethyl sulfoxide solvate
• Formula: C108 H162 N20 O26 S8
• Calculated formula: C108 H162 N20 O26 S8
• Title of publication: Predictably Ordered Open Hydrogen-Bonded Networks Built from Indeno[1,2-b]fluorenes.
• Authors of publication: Beaudoin, Daniel; Blair-Pereira, Joao-Nicolas; Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D.
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2017
• Journal volume: 82
• Journal issue: 16
• Pages of publication: 8536 - 8547
• a: 11.154 ± 0.0005 Å
• b: 14.2902 ± 0.0006 Å
• c: 19.7538 ± 0.0009 Å
• α: 100.214 ± 0.002°
• β: 90.119 ± 0.002°
• γ: 95.774 ± 0.002°
• Cell volume: 3082.4 ± 0.2 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1664
• Residual factor for significantly intense reflections: 0.1488
• Weighted residual factors for significantly intense reflections: 0.4111
• Weighted residual factors for all reflections included in the refinement: 0.4329
• Goodness-of-fit parameter for all reflections included in the refinement: 1.796
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No