Information card for entry 7123351

Structure parameters

• Formula: Bi
• Calculated formula: Bi
• SMILES: [Bi]
• Title of publication: From a volatile molecular precursor to twin-free single crystals of bismuth
• Authors of publication: Wei, Zheng; Dubceac, Cristina; Petrukhina, Marina A.; Dikarev, Evgeny V.
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 4.5392 ± 0.0004 Å
• b: 4.5392 ± 0.0004 Å
• c: 11.8347 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 211.18 ± 0.03 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 1
• Space group number: 166
• Hermann-Mauguin space group symbol: R -3 m
• Hall space group symbol: -R 3 2"
• Residual factor for all reflections: 0.0104
• Residual factor for significantly intense reflections: 0.0104
• Weighted residual factors for significantly intense reflections: 0.0258
• Weighted residual factors for all reflections included in the refinement: 0.0258
• Goodness-of-fit parameter for all reflections included in the refinement: 1.227
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No