Information card for entry 7240967

Structure parameters

• Formula: C13 H13 N O5 S2 Sr
• Calculated formula: C13 H13 N O5 S2 Sr
• Title of publication: Novel alkaline earth metal-organic frameworks with thiophene group for selective detection of Fe3+
• Authors of publication: Yao, Jun; Liu, Yan-E; Yang, Li-Bo; Dou, Ai-Na; Hou, Cheng-Fu; Xu, Quan-Qing; Huang, Bo; Zhu, Ai-Xin
• Journal of publication: CrystEngComm
• Year of publication: 2020
• a: 7.3261 ± 0.0015 Å
• b: 22.72 ± 0.005 Å
• c: 9.936 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1653.8 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0742
• Residual factor for significantly intense reflections: 0.066
• Weighted residual factors for significantly intense reflections: 0.1625
• Weighted residual factors for all reflections included in the refinement: 0.1679
• Goodness-of-fit parameter for all reflections included in the refinement: 1.243
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No