Information card for entry 1565453

Structure parameters

• Formula: C7 H0 Br6 N Sb
• Calculated formula: C7 H10 Br6 N Sb
• SMILES: [Sb](Br)(Br)(Br)(Br)(Br)[Br-].C[n+]1ccc(cc1)C
• Title of publication: Five new Sb(V) bromide complexes and their polybromide derivatives with pyridinium-type cations: Structures, thermal stability and features of halogen⋯halogen contacts in solid state
• Authors of publication: Adonin, Sergey A.; Bondarenko, Mikhail A.; Novikov, Alexander S.; Plyusnin, Pavel E.; Korolkov, Ilya V.; Sokolov, Maxim N.; Fedin, Vladimir P.
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 502
• Pages of publication: 119278
• a: 7.6803 ± 0.0004 Å
• b: 8.59 ± 0.0004 Å
• c: 12.6261 ± 0.0005 Å
• α: 75.226 ± 0.004°
• β: 88.079 ± 0.004°
• γ: 79.872 ± 0.004°
• Cell volume: 792.84 ± 0.07 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0799
• Residual factor for significantly intense reflections: 0.0574
• Weighted residual factors for significantly intense reflections: 0.1436
• Weighted residual factors for all reflections included in the refinement: 0.1655
• Goodness-of-fit parameter for all reflections included in the refinement: 0.933
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No