Information card for entry 4320837

Structure parameters

• Common name: [cesium(tetrabenzo-24-crown-8)tris(acetonitrile)][nitrate]
• Formula: C38 H41 Cs N4 O11
• Calculated formula: C38 H41 Cs N4 O11
• Title of publication: Unusual Ligand Coordination for Cesium
• Authors of publication: Jeffrey C. Bryan; Konstantinos Kavallieratos; Richard A. Sachleben
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 1568 - 1572
• a: 12.0119 ± 0.0014 Å
• b: 13.368 ± 0.0015 Å
• c: 13.7859 ± 0.0012 Å
• α: 89.124 ± 0.008°
• β: 66.928 ± 0.009°
• γ: 71.536 ± 0.01°
• Cell volume: 1916.7 ± 0.4 ų
• Cell temperature: 100 ± 0.2 K
• Ambient diffraction temperature: 100 ± 0.2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.054
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.124
• Weighted residual factors for all reflections included in the refinement: 0.128
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No