Information card for entry 7135915

Structure parameters

• Formula: C36 H26 F12 N4 O9 S4
• Calculated formula: C36 H26 F12 N4 O9 S4
• Title of publication: 2,7-Diazatriptycene: acid-responsive ternary fluorescence switching <i>via</i> modulation of through-space conjugation.
• Authors of publication: Inoue, Ryo; Hashimoto, Yusuke; Aoki, Atsushi; Furuyama, Taniyuki; Kubo, Kazuya; Morisaki, Yasuhiro; Agou, Tomohiro
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2026
• Journal volume: 62
• Journal issue: 38
• Pages of publication: 9725 - 9729
• a: 13.297 ± 0.0004 Å
• b: 21.4099 ± 0.0007 Å
• c: 14.5936 ± 0.0004 Å
• α: 90°
• β: 92.73 ± 0.003°
• γ: 90°
• Cell volume: 4149.9 ± 0.2 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0677
• Residual factor for significantly intense reflections: 0.0537
• Weighted residual factors for significantly intense reflections: 0.1279
• Weighted residual factors for all reflections included in the refinement: 0.1364
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No