Information card for entry 7012884

Structure parameters

• Common name: ((lithium)bis(penta(3,5-dimethylphenyl)cyclopentadienide) (lithium(tetrahydrofuran))(tetrahydrofuran)
• Chemical name: [(lithium)bis(penta(3,5-dimethylphenyl)cyclopentadienide] [lithium(tetrahydrofuran)](tetrahydrofuran)
• Formula: C98 H106 Li2 O2
• Calculated formula: C94 H98 Li2 O
• Title of publication: Synthesis, structure and solution dynamics of lithium salts of superbulky cyclopentadienyl ligands
• Authors of publication: Giesbrecht, Garth R.; Gordon, John C.; Clark, David L.; Scott, Brian L.
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 13
• Pages of publication: 2658
• a: 13.997 ± 0.004 Å
• b: 15.486 ± 0.004 Å
• c: 20.198 ± 0.005 Å
• α: 97.393 ± 0.004°
• β: 102.993 ± 0.005°
• γ: 96.523 ± 0.004°
• Cell volume: 4184.2 ± 1.9 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.138
• Residual factor for significantly intense reflections: 0.0933
• Weighted residual factors for significantly intense reflections: 0.2534
• Weighted residual factors for all reflections included in the refinement: 0.2726
• Goodness-of-fit parameter for all reflections included in the refinement: 1.305
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No