Information card for entry 2241301

Structure parameters

• Chemical name: 2,2''-Bis(2,7-dichloro-9-hydroxy-9<i>H</i>-fluoren-9-yl)-1,1':4',1''-terphenyl triethylamine trisolvate
• Formula: C62 H71 Cl4 N3 O2
• Calculated formula: C62 H71 Cl4 N3 O2
• Title of publication: Crystal structure of 2,2''-bis(2,7-dichloro-9-hydroxy-9<i>H</i>-fluoren-9-yl)-1,1':4',1''-terphenyl triethylamine trisolvate
• Authors of publication: Klien, Henrik; Seichter, Wilhelm; Weber, Edwin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 12
• Pages of publication: 1439 - 1443
• a: 14.5995 ± 0.0002 Å
• b: 14.8094 ± 0.0002 Å
• c: 15.7705 ± 0.0003 Å
• α: 68.373 ± 0.001°
• β: 66.837 ± 0.001°
• γ: 67.558 ± 0.001°
• Cell volume: 2800.13 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0524
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.1029
• Weighted residual factors for all reflections included in the refinement: 0.1131
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes