Information card for entry 4345503

Structure parameters

• Formula: C5 H6 Cd Cl3 N
• Calculated formula: C5 H6 Cd Cl3 N
• Title of publication: Tunable Dielectric Responses Triggered by Dimensionality Modification in Organic-Inorganic Hybrid Phase Transition Compounds (C5H6N)CdnCl2n+1 (n = 1 and 2).
• Authors of publication: Sun, Xiao-Fen; Wang, Zhongxia; Li, Peng-Fei; Liao, Wei-Qiang; Ye, Heng-Yun; Zhang, Yi
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 6
• Pages of publication: 3506 - 3511
• a: 6.7876 ± 0.0014 Å
• b: 7.3532 ± 0.0015 Å
• c: 17.718 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 884.3 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 63
• Hermann-Mauguin space group symbol: A m m a
• Hall space group symbol: -A 2a 2a
• Residual factor for all reflections: 0.0544
• Residual factor for significantly intense reflections: 0.0519
• Weighted residual factors for significantly intense reflections: 0.1153
• Weighted residual factors for all reflections included in the refinement: 0.1171
• Goodness-of-fit parameter for all reflections included in the refinement: 1.111
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No