Information card for entry 7125421

Structure parameters

• Formula: C28 H32 B10 O2
• Calculated formula: C28 H32 B10 O2
• Title of publication: Film-based fluorescence sensing: a "chemical nose" for nicotine.
• Authors of publication: Liu, Ke; Zhang, Jing; Xu, Ling; Liu, Jing; Ding, Liping; Liu, Taihong; Fang, Yu
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2019
• Journal volume: 55
• Journal issue: 84
• Pages of publication: 12679 - 12682
• a: 11.4542 ± 0.0004 Å
• b: 14.4867 ± 0.0005 Å
• c: 17.2981 ± 0.0006 Å
• α: 90°
• β: 94.005 ± 0.001°
• γ: 90°
• Cell volume: 2863.33 ± 0.17 ų
• Cell temperature: 153 K
• Ambient diffraction temperature: 152.99 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: 0.0431
• Residual factor for significantly intense reflections: 0.0407
• Weighted residual factors for significantly intense reflections: 0.1054
• Weighted residual factors for all reflections included in the refinement: 0.1077
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0536
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No