Information card for entry 7118865

Structure parameters

• Formula: C18 H24 Bi2 Br11 N3
• Calculated formula: C18 H24 Bi2 Br11 N3
• Title of publication: Bi(iii) polybromides: a new chapter in coordination chemistry of bismuth.
• Authors of publication: Adonin, Sergey A.; Gorokh, Igor D.; Samsonenko, Denis G.; Sokolov, Maxim N.; Fedin, Vladimir P.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 28
• Pages of publication: 5061 - 5063
• a: 9.5341 ± 0.0003 Å
• b: 21.4727 ± 0.0006 Å
• c: 35.055 ± 0.001 Å
• α: 90°
• β: 97.093 ± 0.003°
• γ: 90°
• Cell volume: 7121.6 ± 0.4 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 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: 0.0761
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1039
• Weighted residual factors for all reflections included in the refinement: 0.1185
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No