Information card for entry 4107053

Structure parameters

• Formula: C70 H64 B F24 N4 O2 Y
• Calculated formula: C70 H64 B F24 N4 O2 Y
• Title of publication: Dihydrogen Addition in a Dinuclear Rare-Earth Metal Hydride Complex Supported by a Metalated TREN Ligand
• Authors of publication: Ajay Venugopal; Waldemar Fegler; Thomas P. Spaniol; Laurent Maron; Jun Okuda
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 17574 - 17577
• a: 10.434 ± 0.004 Å
• b: 18.744 ± 0.007 Å
• c: 18.984 ± 0.007 Å
• α: 93.744 ± 0.006°
• β: 104.85 ± 0.006°
• γ: 100.939 ± 0.006°
• Cell volume: 3498 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1707
• Residual factor for significantly intense reflections: 0.0689
• Weighted residual factors for significantly intense reflections: 0.1229
• Weighted residual factors for all reflections included in the refinement: 0.1513
• Goodness-of-fit parameter for all reflections included in the refinement: 0.852
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No