Information card for entry 7132379

Structure parameters

• Formula: C8 H7 Cs O
• Calculated formula: C8 H7 Cs O
• Title of publication: Isolable rubidium and caesium derivatives of common organic carbonyl compounds.
• Authors of publication: Wacker, Jakoba; Lynch, Jennifer R.; Banerjee, Sumanta; Macdonald, Peter A.; Kennedy, Alan R.; Sarkar, Biprajit; Mulvey, Robert E.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2023
• Journal volume: 60
• Journal issue: 1
• Pages of publication: 91 - 94
• a: 6.7766 ± 0.0001 Å
• b: 8.3061 ± 0.0002 Å
• c: 29.6225 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1667.37 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0584
• Residual factor for significantly intense reflections: 0.0495
• Weighted residual factors for significantly intense reflections: 0.1305
• Weighted residual factors for all reflections included in the refinement: 0.1378
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No