Information card for entry 7113093

Structure parameters

• Chemical name: [K-(2,2,2-crypt)]6[Pb9CdCdPb9]*2en
• Formula: C168 H348 Cd3 K9 N24 O54 Pb27
• Calculated formula: C168 H348.05 Cd3 K9 N24 O54 Pb27
• Title of publication: [Pb9CdCdPb9]6-: a Zintl cluster anion with an unsupported cadmium‒cadmium bond
• Authors of publication: Zhou, Binbin; Denning, Mark S.; Chapman, Thomas A. D.; McGrady, John E.; Goicoechea, Jose M.
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2009
• Journal issue: 46
• Pages of publication: 7221 - 7223
• a: 23.4485 ± 0.0001 Å
• b: 26.7397 ± 0.0001 Å
• c: 43.1335 ± 0.0002 Å
• α: 90°
• β: 103.321 ± 0.0001°
• γ: 90°
• Cell volume: 26317.3 ± 0.19 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• 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: 0.0964
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for significantly intense reflections: 0.0944
• Weighted residual factors for all reflections included in the refinement: 0.1036
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7105071
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No