Information card for entry 8101777

Structure parameters

• Chemical name: bis(μ-oxo)hexakis(2,6-diisopropylphenoxy)ditantalum(V)
• Formula: C72 H102 O8 Ta2
• Calculated formula: C72 H102 O8 Ta2
• Title of publication: Crystal structure of bis(μ-oxo)hexakis(2,6-diisopropyl-phenoxy) ditantalum(V), Ta~2~O~2~(C~12~H~17~O)~6~
• Authors of publication: R. D. Ernst; B. G. Harvey; A. M. Arif
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2005
• Journal volume: 220
• Journal issue: 2
• Pages of publication: 283 - 284
• a: 11.8613 ± 0.0001 Å
• b: 13.2907 ± 0.0002 Å
• c: 13.3311 ± 0.0002 Å
• α: 113.246 ± 0.0007°
• β: 97.4903 ± 0.0009°
• γ: 111.045 ± 0.0008°
• Cell volume: 1709.05 ± 0.04 ų
• Cell temperature: 200 ± 1 K
• Ambient diffraction temperature: 200 ± 1 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0336
• Residual factor for significantly intense reflections: 0.0286
• Weighted residual factors for significantly intense reflections: 0.0633
• Weighted residual factors for all reflections included in the refinement: 0.0655
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No