Information card for entry 7025671

Structure parameters

• Formula: C83 H109 La2 N2 Se2
• Calculated formula: C83 H109 La2 N2 Se2
• Title of publication: Sigma bond metathesis with pentamethylcyclopentadienyl ligands in sterically crowded (C5Me5)3M complexes.
• Authors of publication: Mueller, Thomas J.; Ziller, Joseph W.; Evans, William J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 29
• Pages of publication: 6767 - 6773
• a: 14.9927 ± 0.0009 Å
• b: 15.314 ± 0.0009 Å
• c: 16.9117 ± 0.001 Å
• α: 88.5675 ± 0.0007°
• β: 88.8528 ± 0.0007°
• γ: 79.9654 ± 0.0007°
• Cell volume: 3821.8 ± 0.4 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0305
• Residual factor for significantly intense reflections: 0.0237
• Weighted residual factors for significantly intense reflections: 0.0558
• Weighted residual factors for all reflections included in the refinement: 0.0583
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No