Information card for entry 4510900

Structure parameters

• Formula: C20 H18 Br8 N4 O4 Sb2
• Calculated formula: C20 H16 Br8 N4 O4 Sb2
• SMILES: c1cc(c2ccn(cc2)=O)ccn1=O.Br[Sb]1(Br)(Br)[Br][Sb](Br)([Br]1)(Br)Br.c1cc(ccn1=O)c1ccn(=O)cc1
• Title of publication: ProtonatedN,N′-Dioxide-4,4′-bipyridine, an Interesting Synthon for the Building of Polar H-Bonded Networks?
• Authors of publication: Leblanc, Nicolas; Allain, Magali; Mercier, Nicolas; Cariati, Elena
• Journal of publication: Crystal Growth & Design
• Year of publication: 2011
• Journal volume: 11
• Journal issue: 12
• Pages of publication: 5200
• a: 6.0397 ± 0.0009 Å
• b: 15.037 ± 0.001 Å
• c: 18.109 ± 0.002 Å
• α: 90°
• β: 99.52 ± 0.01°
• γ: 90°
• Cell volume: 1622 ± 0.3 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0389
• Weighted residual factors for all reflections included in the refinement: 0.0811
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No