Information card for entry 7026056

Structure parameters

• Common name: Mesityllithium
• Chemical name: Mesityllithium
• Formula: C18 H22 Li2
• Calculated formula: C18 H22 Li2
• SMILES: C1(C)=CC(C)=[C]2(C(=C1)C)[Li][C]1(=C(C)C=C(C)C=C1C)[Li]2
• Title of publication: Solvent-free mesityllithium: solid-state structure and its reactivity towards white phosphorus.
• Authors of publication: Hübner, Alexander; Bernert, Thomas; Sänger, Inge; Alig, Edith; Bolte, Michael; Fink, Lothar; Wagner, Matthias; Lerner, Hans-Wolfram
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 32
• Pages of publication: 7528 - 7533
• a: 15.27957 ± 0.00061 Å
• b: 10.61806 ± 0.00043 Å
• c: 4.74612 ± 0.00019 Å
• α: 90°
• β: 96.5964 ± 0.0017°
• γ: 90°
• Cell volume: 764.91 ± 0.05 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• 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 R(I) for significantly intense reflections: 0.009115
• Goodness-of-fit parameter for all reflections: 1.516
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 1.54056 Å
• Diffraction radiation type: CuKα~1~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No