Information card for entry 2239353

Structure parameters

• Common name: 1102
• Chemical name: (2.2.2-Cryptand)potassium tetracarbonylcobaltate(-I)
• Formula: C22 H36 Co K N2 O10
• Calculated formula: C22 H36 Co K N2 O10
• SMILES: [Co](C#[O])(C#[O])(C#[O])C#[O].[K]1234567[N]89CC[O]1CC[O]2CC[N]7(CC[O]4CC[O]3CC8)CC[O]6CC[O]5CC9
• Title of publication: (2.2.2-Cryptand)potassium tetracarbonylcobaltate({-}I)
• Authors of publication: Brennessel, William W.; Ellis, John E.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 5
• Pages of publication: m180
• a: 9.3611 ± 0.0018 Å
• b: 12.022 ± 0.002 Å
• c: 25.358 ± 0.005 Å
• α: 90°
• β: 91.536 ± 0.004°
• γ: 90°
• Cell volume: 2852.7 ± 0.9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.0637
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.085
• Weighted residual factors for all reflections included in the refinement: 0.0931
• Goodness-of-fit parameter for all reflections included in the refinement: 0.918
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes