Information card for entry 4071771

Structure parameters

• Formula: C14 H20 Co Si2
• Calculated formula: C14 H20 Co Si2
• SMILES: [Co]123456789[c]%10([cH]1[cH]2[cH]3[cH]4%10)[Si](C)(C)[Si]([c]15[cH]6[cH]7[cH]8[cH]91)(C)C
• Title of publication: Synthesis, Crystal Structure, EPR and DFT Studies, and Redox Properties of [2]Tetramethyldisilacobaltocenophane
• Authors of publication: Braunschweig, Holger; Breher, Frank; Kaupp, Martin; Gross, Manuela; Kupfer, Thomas; Nied, Dominik; Radacki, Krzysztof; Schinzel, Sandra
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 24
• Pages of publication: 6427
• a: 8.2595 ± 0.0003 Å
• b: 10.3127 ± 0.0005 Å
• c: 8.5719 ± 0.0004 Å
• α: 90°
• β: 90.38 ± 0.002°
• γ: 90°
• Cell volume: 730.12 ± 0.06 ų
• Cell temperature: 99 ± 2 K
• Ambient diffraction temperature: 99 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0195
• Residual factor for significantly intense reflections: 0.018
• Weighted residual factors for significantly intense reflections: 0.0519
• Weighted residual factors for all reflections included in the refinement: 0.0626
• Goodness-of-fit parameter for all reflections included in the refinement: 1.197
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No