Information card for entry 4337317

Structure parameters

• Common name: 10
• Formula: C28.33 H32.67 B Br Cl0.67 N4 O0.5
• Calculated formula: C26.3333 H28.6667 B Br Cl0.666667 N4
• Title of publication: Synthesis and luminescent properties of lewis base-appended borafluorenes.
• Authors of publication: Berger, Christopher J.; He, Gang; Merten, Christian; McDonald, Robert; Ferguson, Michael J.; Rivard, Eric
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 3
• Pages of publication: 1475 - 1486
• a: 29.9685 ± 0.0007 Å
• b: 12.7445 ± 0.0003 Å
• c: 43.8064 ± 0.001 Å
• α: 90°
• β: 91.3286 ± 0.0004°
• γ: 90°
• Cell volume: 16726.6 ± 0.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0909
• Residual factor for significantly intense reflections: 0.0659
• Weighted residual factors for significantly intense reflections: 0.1866
• Weighted residual factors for all reflections included in the refinement: 0.1996
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No