Information card for entry 4087584

Structure parameters

• Formula: C57 H62 N2 P Ta
• Calculated formula: C57 H62 N2 P Ta
• Title of publication: Hydrogenolysis of Tantalum Hydrocarbyl Complexes: Intermediates on the Road to a Dinuclear Tantalum Tetrahydride Derivative
• Authors of publication: Parker, Kyle D. J.; Nied, Dominik; Fryzuk, Michael D.
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 14
• Pages of publication: 3546
• a: 11.4235 ± 0.0002 Å
• b: 12.6093 ± 0.0002 Å
• c: 18.0686 ± 0.0003 Å
• α: 82.5839 ± 0.0008°
• β: 89.1893 ± 0.0008°
• γ: 77.0839 ± 0.0008°
• Cell volume: 2515.28 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.15 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: 0.0424
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.0632
• Weighted residual factors for all reflections included in the refinement: 0.0672
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No