Information card for entry 4301840

Structure parameters

• Chemical name: [K-(2,2,2-crypt)]6[Sn9CdSn(C4H9)3]2*6tol*py
• Formula: C179 H323 Cd2 K6 N13 O36 Sn20
• Calculated formula: C179 H323 Cd2 K6 N13 O36 Sn20
• Title of publication: Coupling Reactions of Functionalized Zintl Ions [E9Cd(C6H5)]3- (E = Sn, Pb) with Tributyltinhydride: Synthesis and Isolation of {Sn9CdSn[(CH2)3CH3]3}3-
• Authors of publication: Binbin Zhou; Mark S. Denning; Thomas A. D. Chapman; Jose M. Goicoechea
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 2899 - 2907
• a: 15.5506 ± 0.0001 Å
• b: 28.2557 ± 0.0002 Å
• c: 28.9528 ± 0.0002 Å
• α: 78.8039 ± 0.0002°
• β: 75.0316 ± 0.0002°
• γ: 76.5925 ± 0.0003°
• Cell volume: 11832.4 ± 0.14 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1001
• Residual factor for significantly intense reflections: 0.0523
• Weighted residual factors for significantly intense reflections: 0.1278
• Weighted residual factors for all reflections included in the refinement: 0.1519
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No