Information card for entry 4075554

Structure parameters

• Formula: C25 H36 Sn
• Calculated formula: C25 H36 Sn
• SMILES: [Sn](C1(c2c(c(c(c(c2c2c(c(c(c(c12)C)C)C)C)C)C)C)C)C)(C)(C)C
• Title of publication: Bulk Synthesis of Octa- and Nonamethylfluorene (Flu‘ ‘H and Flu*H) and the Characterization of the Organometallic Derivatives Flu*SnMe3, [(FeCp)2Flu*H][PF6]2, and [(FeCp)2Flu‘ ‘H][PF6]2
• Authors of publication: Moss, James; Thomas, Jemima; Ashley, Andrew; Cowley, Andrew R.; O'Hare, Dermot
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 18
• Pages of publication: 4279
• a: 11.086 ± 0.0002 Å
• b: 17.6453 ± 0.0004 Å
• c: 12.0116 ± 0.0003 Å
• α: 90°
• β: 111.831 ± 0.0013°
• γ: 90°
• Cell volume: 2181.15 ± 0.09 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Sample thermal history: The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.
• Number of distinct elements: 3
• 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: 0.0482
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for all reflections: 0.053
• Weighted residual factors for significantly intense reflections: 0.034
• Weighted residual factors for all reflections included in the refinement: 0.034
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1174
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No