Information card for entry 7231703

Structure parameters

• Formula: C10 H10 Bi Br7 N2
• Calculated formula: C10 H10 Bi Br7 N2
• Title of publication: Halobismuthates with halopyridinium cations: appearance or non-appearance of unusual colouring
• Authors of publication: Adonin, Sergey A.; Gorokh, Igor D.; Novikov, Alexander S.; Samsonenko, Denis G.; Yushina, Irina V.; Sokolov, Maxim N.; Fedin, Vladimir P.
• Journal of publication: CrystEngComm
• Year of publication: 2018
• Journal volume: 20
• Journal issue: 48
• Pages of publication: 7766
• a: 9.1733 ± 0.0003 Å
• b: 10.5445 ± 0.0003 Å
• c: 10.733 ± 0.0004 Å
• α: 100.26 ± 0.003°
• β: 97.127 ± 0.003°
• γ: 108.312 ± 0.003°
• Cell volume: 951.67 ± 0.06 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 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: 0.039
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0525
• Weighted residual factors for all reflections included in the refinement: 0.056
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No