Information card for entry 4325104

Structure parameters

• Formula: C14 H21 Br3 La N7
• Calculated formula: C14 H21 Br3 La N7
• SMILES: [La](Br)(Br)(Br)([N]#CC)([N]#CC)([N]#CC)([N]#CC)[N]#CC.N#CC.N#CC
• Title of publication: An Ionic Liquid-Mediated Route to Cerium(III) Bromide Solvates
• Authors of publication: Kalyan V. Vasudevan; Nickolaus A. Smith; Brian L. Scott; Edward A. McKigney; Michael W. Blair; John C. Gordon; Ross E. Muenchausen
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 4627 - 4631
• a: 8.995 ± 0.002 Å
• b: 12.433 ± 0.003 Å
• c: 21.698 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2426.6 ± 1 ų
• Cell temperature: 140 ± 1 K
• Ambient diffraction temperature: 140 ± 1 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0812
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for significantly intense reflections: 0.1086
• Weighted residual factors for all reflections included in the refinement: 0.1216
• Goodness-of-fit parameter for all reflections included in the refinement: 1.119
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No