Information card for entry 1504663

Structure parameters

• Formula: C41 H34 F18 N2 P2 S2
• Calculated formula: C41 H34 F18 N2 P2 S2
• Title of publication: Control of the photoreactivity of diarylethene derivatives by quaternarization of the pyridylethynyl group.
• Authors of publication: Yumoto, Koji; Irie, Masahiro; Matsuda, Kenji
• Journal of publication: Organic letters
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 10
• Pages of publication: 2051 - 2054
• a: 26.0526 ± 0.0014 Å
• b: 33.9275 ± 0.0019 Å
• c: 9.413 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8320.1 ± 0.8 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 6
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.0525
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.1423
• Weighted residual factors for all reflections included in the refinement: 0.1485
• Goodness-of-fit parameter for all reflections included in the refinement: 1.147
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No