Information card for entry 7210559

Structure parameters

• Formula: C18 H12 O15 Pr2 S3
• Calculated formula: C18 H12 O15 Pr2 S3
• Title of publication: Three-dimensional pillared layered supramolecular networks comprising polymeric layers and tetrameric {H2O}4 pillars
• Authors of publication: Li, Zhao-Hao; Zhang, Tian; Xue, Li-Ping; Miao, Shao-Bin; Zhao, Bang-Tun; Kan, Jian; Su, Wei-Ping
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 37
• Pages of publication: 7423
• a: 9.0148 ± 0.0015 Å
• b: 10.4259 ± 0.0018 Å
• c: 13.458 ± 0.002 Å
• α: 100.259 ± 0.002°
• β: 102.113 ± 0.002°
• γ: 103.114 ± 0.002°
• Cell volume: 1170.1 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0237
• Residual factor for significantly intense reflections: 0.0216
• Weighted residual factors for significantly intense reflections: 0.0554
• Weighted residual factors for all reflections included in the refinement: 0.0568
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No