Information card for entry 7700987

Structure parameters

• Formula: C99 H77 N13 O21 Th4
• Calculated formula: C99 H77 N13 O21 Th4
• Title of publication: Tetranuclear oxido-bridged thorium(iv) clusters obtained using tridentate Schiff bases.
• Authors of publication: Tsantis, Sokratis T.; Lagou-Rekka, Aimilia; Konidaris, Konstantis F.; Raptopoulou, Catherine P.; Bekiari, Vlasoula; Psycharis, Vassilis; Perlepes, Spyros P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 41
• Pages of publication: 15668 - 15678
• a: 13.5738 ± 0.0003 Å
• b: 14.9072 ± 0.0003 Å
• c: 26.8572 ± 0.0005 Å
• α: 81.513 ± 0.001°
• β: 76.826 ± 0.001°
• γ: 61.585 ± 0.001°
• Cell volume: 4649.11 ± 0.17 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 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: 0.0403
• Residual factor for significantly intense reflections: 0.0295
• Weighted residual factors for significantly intense reflections: 0.0544
• Weighted residual factors for all reflections included in the refinement: 0.0576
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No