Information card for entry 7706664

Structure parameters

• Chemical name: 8-bis(4-fluorophenyl)-2,2,6,6-tetraphenyl- 1,3,5,7,2,6,4,8-tetraoxadisiladiborocane
• Formula: C36 H28 B2 F2 O4 Si2
• Calculated formula: C36 H28 B2 F2 O4 Si2
• Title of publication: First example of solid-state luminescent borasiloxane-based chiral helices assembled through N-B bonds.
• Authors of publication: Podda, Enrico; Coles, Simon J.; Horton, Peter N.; Lickiss, Paul D.; Bull, Okpara S.; Orton, James B.; Pintus, Anna; Pugh, David; Carla Aragoni, M.; Davies, Robert P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 11
• Pages of publication: 3782 - 3785
• a: 8.5686 ± 0.0006 Å
• b: 9.8331 ± 0.001 Å
• c: 11.3579 ± 0.0008 Å
• α: 112.478 ± 0.008°
• β: 108.622 ± 0.006°
• γ: 91.091 ± 0.007°
• Cell volume: 827.02 ± 0.14 ų
• Cell temperature: 173 ± 0.1 K
• Ambient diffraction temperature: 173 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0714
• Residual factor for significantly intense reflections: 0.0467
• Weighted residual factors for significantly intense reflections: 0.0941
• Weighted residual factors for all reflections included in the refinement: 0.1018
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No