Information card for entry 7004164

Structure parameters

• Formula: C5 H19 Bi N2 O14 S3
• Calculated formula: C5 H16 Bi N2 O14 S3
• Title of publication: Synthesis and structural characterization of four new organically-directed bismuth sulfates
• Authors of publication: Fu, Yunlong; Zhang, Yu; Xu, Zhiwei
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 35
• Pages of publication: 4792 - 4798
• a: 6.5483 ± 0.0004 Å
• b: 24.8079 ± 0.0017 Å
• c: 10.1736 ± 0.0007 Å
• α: 90°
• β: 102.545 ± 0.001°
• γ: 90°
• Cell volume: 1613.24 ± 0.19 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• 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: 0.0396
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.0944
• Weighted residual factors for all reflections included in the refinement: 0.0974
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No