Information card for entry 7041454

Structure parameters

• Common name: (Mes2(p-OMePh)Corrole)Ta(NtBu)
• Formula: C55 H54 N5 O Ta
• Calculated formula: C55 H54 N5 O Ta
• Title of publication: Synthesis and reactivity of tantalum corrole complexes.
• Authors of publication: Ziegler, Jessica A.; Buckley, Heather L.; Arnold, John
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 3
• Pages of publication: 780 - 785
• a: 12.555 ± 0.005 Å
• b: 14.05 ± 0.005 Å
• c: 14.078 ± 0.005 Å
• α: 97.483 ± 0.005°
• β: 91.176 ± 0.005°
• γ: 113.701 ± 0.005°
• Cell volume: 2247.2 ± 1.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0303
• Residual factor for significantly intense reflections: 0.0261
• Weighted residual factors for significantly intense reflections: 0.0577
• Weighted residual factors for all reflections included in the refinement: 0.06
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No