Information card for entry 8105279

Structure parameters

• Chemical name: 'Caesium(I)-Bis(1,4,7,10-tetraoxacyclo' dodecane)-pentaiodide'
• Formula: C16 H32 Cs I7 O8
• Calculated formula: C16 H32 Cs I7 O8
• Title of publication: Crystal structure and antimicrobial properties of (1,4,7,10-tetraoxacyclododecane-κ4 O,O′,O′′,O′′′)cesium(I) pentaiodide, C16H32CsI5O8
• Authors of publication: Bloukh, Samir Haj; Edis, Zehra
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2020
• Journal volume: 235
• Journal issue: 3
• Pages of publication: 759 - 761
• a: 16.386 ± 0.002 Å
• b: 11.705 ± 0.001 Å
• c: 19.005 ± 0.003 Å
• α: 90°
• β: 108.008 ± 0.014°
• γ: 90°
• Cell volume: 3466.6 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0491
• Residual factor for significantly intense reflections: 0.0437
• Weighted residual factors for significantly intense reflections: 0.1062
• Weighted residual factors for all reflections included in the refinement: 0.1085
• Goodness-of-fit parameter for all reflections included in the refinement: 1.268
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No