Information card for entry 4077491

Structure parameters

• Formula: C48 H77 Li2 N2 O1.5
• Calculated formula: C48 H72 Li2 N2 O1.5
• Title of publication: Transition Metal Complexes with Sterically Demanding Ligands. 2.1Meisenheimer Complex Formation and Deprotonation Reactions of a Sterically Demanding Aromatic Diimine†
• Authors of publication: Nückel, Stefan; Burger, Peter
• Journal of publication: Organometallics
• Year of publication: 2000
• Journal volume: 19
• Journal issue: 17
• Pages of publication: 3305
• a: 12.979 ± 0.001 Å
• b: 15.703 ± 0.001 Å
• c: 22.942 ± 0.002 Å
• α: 90°
• β: 94.61 ± 0.01°
• γ: 90°
• Cell volume: 4660.7 ± 0.6 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1319
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for all reflections: 0.0719
• Weighted residual factors for significantly intense reflections: 0.06
• Goodness-of-fit parameter for all reflections: 0.644
• Goodness-of-fit parameter for significantly intense reflections: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No