Information card for entry 4072240

Structure parameters

• Formula: C25 H26 Cl F3 N O7 S Ta
• Calculated formula: C25 H26 Cl F3 N O7 S Ta
• Title of publication: Oxo and Hydroxo Organometallic Complexes of Tantalum: Soluble Molecular Models of Tantalum Oxide
• Authors of publication: Conde, Ana; Fandos, Rosa; Otero, Antonio; Rodríguez, Ana
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 23
• Pages of publication: 6090
• a: 8.9762 ± 0.0011 Å
• b: 14.6889 ± 0.0017 Å
• c: 20.673 ± 0.002 Å
• α: 90°
• β: 91.598 ± 0.002°
• γ: 90°
• Cell volume: 2724.7 ± 0.5 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 8
• 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: 0.0648
• Residual factor for significantly intense reflections: 0.0423
• Weighted residual factors for significantly intense reflections: 0.088
• Weighted residual factors for all reflections included in the refinement: 0.0956
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No