Information card for entry 7239515

Structure parameters

• Formula: C4 H12 B O12 Rb Sr
• Calculated formula: C4 H12 B O12 Rb Sr
• Title of publication: New tartratoborates: synthesis, structure, and characterization of non-centrosymmetric ASr[C4H2O6B(OH)2]·4H2O (A = K+, Rb+)
• Authors of publication: Fan, Xiaoyun; Pan, Shilie; Guo, Jing; Hou, Xueling; Han, Jian; Zhang, Fangfang; Li, Feng; Poeppelmeier, Kenneth R.
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2013
• Journal volume: 1
• Journal issue: 35
• Pages of publication: 10389
• a: 6.4606 ± 0.0011 Å
• b: 7.0808 ± 0.0012 Å
• c: 7.1089 ± 0.0012 Å
• α: 84.753 ± 0.002°
• β: 77.266 ± 0.002°
• γ: 73.183 ± 0.002°
• Cell volume: 303.51 ± 0.09 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0245
• Residual factor for significantly intense reflections: 0.0231
• Weighted residual factors for significantly intense reflections: 0.0556
• Weighted residual factors for all reflections included in the refinement: 0.0563
• Goodness-of-fit parameter for all reflections included in the refinement: 0.712
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No