Information card for entry 7038118

Structure parameters

• Formula: C6 H8 Bi Br4 N
• Calculated formula: C6 H8 Bi Br4 N
• Title of publication: Trapping molecular bromine: a one-dimensional bromobismuthate complex with Br2 as a linker.
• Authors of publication: Adonin, S. A.; Gorokh, I. D.; Abramov, P. A.; Plyusnin, P. E.; Sokolov, M. N.; Fedin, V. P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 9
• Pages of publication: 3691 - 3693
• a: 7.47341 ± 0.00015 Å
• b: 13.3443 ± 0.0002 Å
• c: 12.4703 ± 0.0002 Å
• α: 90°
• β: 91.9932 ± 0.0016°
• γ: 90°
• Cell volume: 1242.88 ± 0.04 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0289
• Residual factor for significantly intense reflections: 0.0219
• Weighted residual factors for significantly intense reflections: 0.0424
• Weighted residual factors for all reflections included in the refinement: 0.044
• Goodness-of-fit parameter for all reflections included in the refinement: 1.105
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No