Information card for entry 7121668

Structure parameters

• Formula: C16 H9 B F2 I N O2
• Calculated formula: C16 H9 B F2 I N O2
• Title of publication: Fluorescence/phosphorescence-conversion in self-assembled organic microcrystals.
• Authors of publication: Tao, Yi-Chen; Li, Zhi-Zhou; Wang, Xue-Dong; Xiao, Lu; Fu, Hongbing; Liao, Liang-Sheng
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 46
• Pages of publication: 5895 - 5898
• a: 8.1072 ± 0.0016 Å
• b: 10.316 ± 0.002 Å
• c: 18.661 ± 0.004 Å
• α: 85.33 ± 0.03°
• β: 85.74 ± 0.03°
• γ: 82.69 ± 0.03°
• Cell volume: 1539.6 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0801
• Residual factor for significantly intense reflections: 0.072
• Weighted residual factors for significantly intense reflections: 0.1203
• Weighted residual factors for all reflections included in the refinement: 0.1247
• Goodness-of-fit parameter for all reflections included in the refinement: 1.23
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No