Information card for entry 4082798

Structure parameters

• Formula: C26 H44 Co F6 P Sn2
• Calculated formula: C26 H44 Co F6 P Sn2
• SMILES: [Co]123456789[c]%10([cH]4[cH]3[cH]2[cH]1%10)[Sn]([Sn]([c]15[cH]6[cH]7[cH]8[cH]91)(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Tin-Bridgedansa-Metallocenes of the Late Transition Metals Cobalt and Nickel: Preparation, Molecular and Electronic Structures, and Redox Chemistry
• Authors of publication: Arnold, Thomas; Braunschweig, Holger; Damme, Alexander; Hörl, Christian; Kramer, Thomas; Krummenacher, Ivo; Mager, Julian
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 7
• Pages of publication: 1659
• a: 37.404 ± 0.003 Å
• b: 17.1777 ± 0.0013 Å
• c: 9.5402 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6129.7 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0387
• Residual factor for significantly intense reflections: 0.0318
• Weighted residual factors for significantly intense reflections: 0.053
• Weighted residual factors for all reflections included in the refinement: 0.0551
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No