Information card for entry 7200642

Structure parameters

• Common name: (TAMS)Bi2Cl8
• Chemical name: (TAMS)Bi2Cl8
• Formula: C17 H22 Bi2 Cl8 N2
• Calculated formula: C17 H22 Bi2 Cl8 N2
• Title of publication: A ferroelectric inorganic‒organic hybrid based on NLO-phore stilbazolium
• Authors of publication: Xu, Gang; Li, Yan; Zhou, Wei-Wei; Wang, Guo-Jian; Long, Xi-Fa; Cai, Li-Zhen; Wang, Ming-Sheng; Guo, Guo-Cong; Huang, Jin-Shun; Bator, Grazyna; Jakubas, Ryszard
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2009
• Journal volume: 19
• Journal issue: 15
• Pages of publication: 2179
• a: 32.458 ± 0.004 Å
• b: 7.1893 ± 0.0009 Å
• c: 11.7654 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2745.5 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0674
• Residual factor for significantly intense reflections: 0.0591
• Weighted residual factors for significantly intense reflections: 0.1487
• Weighted residual factors for all reflections included in the refinement: 0.1552
• Goodness-of-fit parameter for all reflections included in the refinement: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No