Information card for entry 7226246

Structure parameters

• Formula: C8 H5 Cl2 O3 Tl
• Calculated formula: C8 H5 Cl2 O3 Tl
• Title of publication: Solid-state Conversion of Double Helix Thallium(I) Coordination Polymer to Corrugated Tape Silver(I) Polymer
• Authors of publication: Moeinian, Maryam; Akhbari, Kamran; Kawata, Satoshi; Ishikawa, Ryuta
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 17.903 ± 0.002 Å
• b: 3.9651 ± 0.0005 Å
• c: 13.9329 ± 0.0016 Å
• α: 90°
• β: 98.904 ± 0.004°
• γ: 90°
• Cell volume: 977.1 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0913
• Residual factor for significantly intense reflections: 0.0628
• Weighted residual factors for significantly intense reflections: 0.148
• Weighted residual factors for all reflections included in the refinement: 0.1623
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No