Information card for entry 4327216

Structure parameters

• Formula: C37 H30 Co11 Nb O17 Te5
• Calculated formula: C37 H30 Co11 Nb O17 Te5
• SMILES: C(#[O])[Co]123456[Co]789%10%11%12%13%14%15%16[Co]%17%18%19%20%21(C(=O)[Co]%22%23%2417%17(C(=O)[Co]17%17%25%15%24([Te]3%23[Co]3%15597([Te]54[Co]4796%10([Te]28%18%22[Co]26%12%207(C#[O])C(=O)[Co]78%10%132(C#[O])[Co]%11354(C#[O])([Te]%16%25%158[Co]%14%21%177(C#[O])(C%19=O)C1=O)[Te]96%10)C#[O])C#[O])C#[O])C#[O])C#[O].[c]12([c]3([Nb]4567892([c]1([c]4(C)[c]35C)C)(C#[O])(C#[O])[c]1([c]6([c]7([c]8([c]91C)C)C)C)C)C)C
• Title of publication: Electron-Sponge Behavior and Electronic Structures in Cobalt-Centered Pentagonal Prismatic Co11Te7(CO)10 and Co11Te5(CO)15 Cluster Anions
• Authors of publication: Olivier Cador; Hélène Cattey; Jean-François Halet; Walter Meier; Yves Mugnier; Joachim Wachter; Jean-Yves Saillard; Bachir Zouchoune; Manfred Zabel
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 501 - 509
• a: 15.6403 ± 0.0017 Å
• b: 16.6383 ± 0.0015 Å
• c: 20.448 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5321.1 ± 1.1 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 ± 1 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0858
• Residual factor for significantly intense reflections: 0.0322
• Weighted residual factors for significantly intense reflections: 0.0779
• Weighted residual factors for all reflections included in the refinement: 0.1072
• Goodness-of-fit parameter for all reflections included in the refinement: 0.553
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No