Information card for entry 7236792

Structure parameters

• Formula: C30 H40 B N
• Calculated formula: C30 H40 B N
• Title of publication: H-Bond assisted mechanoluminescence of borylated aryl amines: tunable emission and polymorphism
• Authors of publication: Sudhakar, Pagidi; Neena, Kalluvettukuzhy K.; Thilagar, Pakkirisamy
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2017
• Journal volume: 5
• Journal issue: 26
• Pages of publication: 6537
• a: 7.881 ± 0.004 Å
• b: 11.54 ± 0.007 Å
• c: 15.256 ± 0.008 Å
• α: 75.47 ± 0.018°
• β: 87.554 ± 0.018°
• γ: 78.835 ± 0.018°
• Cell volume: 1317.7 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1407
• Residual factor for significantly intense reflections: 0.0854
• Weighted residual factors for significantly intense reflections: 0.2244
• Weighted residual factors for all reflections included in the refinement: 0.2383
• Goodness-of-fit parameter for all reflections included in the refinement: 1.181
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No