Information card for entry 7127975

Structure parameters

• Common name: suitane
• Chemical name: suitane
• Formula: C30 H20 B F4 N2 O12
• Calculated formula: C274.552 H289.884 B4 F16 N8 O44
• Title of publication: Fluorescence emission enhancement of a T-shaped benzimidazole with a mechanically-interlocked 'suit'.
• Authors of publication: Xu, Houyang; Lin, Meng-Di; Yuan, Jun; Zhou, Baiyang; Mu, Yingxiao; Huo, Yanping; Zhu, Kelong
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 26
• Pages of publication: 3239 - 3242
• a: 15.4345 ± 0.0008 Å
• b: 27.2605 ± 0.0016 Å
• c: 18.41 ± 0.0011 Å
• α: 90°
• β: 115.234 ± 0.002°
• γ: 90°
• Cell volume: 7006.9 ± 0.7 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• 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: 0.1087
• Residual factor for significantly intense reflections: 0.0891
• Weighted residual factors for significantly intense reflections: 0.2639
• Weighted residual factors for all reflections included in the refinement: 0.2832
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 1.34138 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No