Information card for entry 4069762

Structure parameters

• Formula: C24 H23 B F8.5 N2.5 O2 S
• Calculated formula: C24 H23 B F8.5 N2.5 O2 S
• Title of publication: Perfluoroaryl-Substituted Boron Dipyrrinato Complexes
• Authors of publication: Bonnier, Catherine; Piers, Warren E.; Al-Sheikh Ali, Adeeb; Thompson, Alison; Parvez, Masood
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 16
• Pages of publication: 4845
• a: 45.488 ± 0.009 Å
• b: 12.342 ± 0.002 Å
• c: 19.417 ± 0.003 Å
• α: 90°
• β: 105.48 ± 0.02°
• γ: 90°
• Cell volume: 10506 ± 3 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: 0.1087
• Residual factor for significantly intense reflections: 0.077
• Weighted residual factors for significantly intense reflections: 0.1669
• Weighted residual factors for all reflections included in the refinement: 0.1864
• Goodness-of-fit parameter for all reflections included in the refinement: 1.117
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No