Information card for entry 7122800

Structure parameters

• Formula: C116.5 H138.5 N4 O2
• Calculated formula: C116.5 H138.5 N4 O2
• Title of publication: Visible light intensity dependent negative photochromism of a binaphthyl-bridged phenoxyl-imidazolyl radical complex.
• Authors of publication: Yonekawa, Izumi; Mutoh, Katsuya; Abe, Jiro
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2019
• a: 17.5774 ± 0.0013 Å
• b: 19.6323 ± 0.0013 Å
• c: 29.878 ± 0.003 Å
• α: 90°
• β: 105.803 ± 0.003°
• γ: 90°
• Cell volume: 9920.7 ± 1.4 ų
• Cell temperature: 103 K
• Ambient diffraction temperature: 103 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.12
• Residual factor for significantly intense reflections: 0.0839
• Weighted residual factors for significantly intense reflections: 0.2525
• Weighted residual factors for all reflections included in the refinement: 0.2867
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No