Information card for entry 7103296

Structure parameters

• Common name: 1,2-Bis(3-methyl-5phenylthien-1,1dioxa-2-yl)- perfluorocyclopentene
• Chemical name: 1,2-Bis(3-methyl-5phenylthien-1,1dioxa-2-yl)-perfluorocyclopentene
• Formula: C27 H18 F6 O4 S2
• Calculated formula: C27 H18 F6 O4 S2
• Title of publication: Invisible photochromism of diarylethene derivatives.
• Authors of publication: Fukaminato, Tuyoshi; Tanaka, Masaaki; Kuroki, Lumi; Irie, Masahiro
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 33
• Pages of publication: 3924 - 3926
• a: 13.0067 ± 0.0011 Å
• b: 13.4973 ± 0.0011 Å
• c: 18.0024 ± 0.0015 Å
• α: 70.273 ± 0.001°
• β: 89.539 ± 0.001°
• γ: 61.661 ± 0.001°
• Cell volume: 2573.9 ± 0.4 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 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: 0.1108
• Residual factor for significantly intense reflections: 0.0747
• Weighted residual factors for significantly intense reflections: 0.2044
• Weighted residual factors for all reflections included in the refinement: 0.2319
• Goodness-of-fit parameter for all reflections included in the refinement: 1.382
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No