Information card for entry 4323482

Structure parameters

• Chemical name: Thallium Tris tetracarbonyl Cobaltate.
• Formula: C12 Co3 O12 Tl
• Calculated formula: C12 Co3 O12 Tl
• SMILES: [Tl]([Co](C#[O])(C#[O])(C#[O])C#[O])([Co](C#[O])(C#[O])(C#[O])C#[O])[Co](C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: Solution Dynamics of Thallium-Metal Carbonyl Compounds Using 205Tl NMR Spectroscopy
• Authors of publication: Jaap W. van Hal; Lawrence B. Alemany; Kenton H. Whitmire
• Journal of publication: Inorganic Chemistry
• Year of publication: 1997
• Journal volume: 36
• Pages of publication: 3152 - 3159
• a: 16.855 ± 0.003 Å
• b: 6.779 ± 0.001 Å
• c: 19.049 ± 0.004 Å
• α: 90°
• β: 113.84 ± 0.03°
• γ: 90°
• Cell volume: 1990.8 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0304
• Residual factor for significantly intense reflections: 0.0221
• Weighted residual factors for all reflections: 0.0573
• Weighted residual factors for significantly intense reflections: 0.0542
• Goodness-of-fit parameter for all reflections: 1.07
• Goodness-of-fit parameter for significantly intense reflections: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No