Information card for entry 7211240

Structure parameters

• Formula: C10 H9 Bi Br4 N2 O
• Calculated formula: C10 H9 Bi Br4 N2 O
• Title of publication: Protonated N-oxide-4,4′-bipyridine: from luminescent BiIII complexes to hybrids based on H-bonded dimers or H-bonded open 2D square supramolecular networks
• Authors of publication: Toma, Oksana; Mercier, Nicolas; Allain, Magali; Botta, Chiara
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 42
• Pages of publication: 8565
• a: 8.4049 ± 0.0008 Å
• b: 21.2014 ± 0.0018 Å
• c: 9.3965 ± 0.0006 Å
• α: 90°
• β: 107.241 ± 0.005°
• γ: 90°
• Cell volume: 1599.2 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.1326
• Residual factor for significantly intense reflections: 0.0517
• Weighted residual factors for significantly intense reflections: 0.0973
• Weighted residual factors for all reflections included in the refinement: 0.1205
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No