Information card for entry 7201345

Structure parameters

• Formula: C16 H16 In2 O19 S2
• Calculated formula: C16 H12 In2 O19 S2.003
• Title of publication: Double-walled tubular metal‒organic frameworks constructed from bi-strand helices
• Authors of publication: Gao, Qiang; Wu, Ming-Yan; Huang, You-Gui; Chen, Lian; Wei, Wei; Zhang, Qing-Fu; Jiang, Fei-Long; Hong, Mao-Chun
• Journal of publication: CrystEngComm
• Year of publication: 2009
• Journal volume: 11
• Journal issue: 9
• Pages of publication: 1831
• a: 27.652 ± 0.005 Å
• b: 27.652 ± 0.005 Å
• c: 20.028 ± 0.009 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 13262 ± 7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 166
• Hermann-Mauguin space group symbol: R -3 m :H
• Hall space group symbol: -R 3 2"
• Residual factor for all reflections: 0.0658
• Residual factor for significantly intense reflections: 0.06
• Weighted residual factors for significantly intense reflections: 0.1757
• Weighted residual factors for all reflections included in the refinement: 0.182
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No