Information card for entry 7026218

Structure parameters

• Formula: C42 H72 Mg5 O19 Ti
• Calculated formula: C43.86 Mg4.98 O19 Ti1.02
• Title of publication: Highly symmetric organic ligand-capped Lindqvist structures derived from 3d-elements.
• Authors of publication: Seisenbaeva, Gulaim A.; Mallah, Talal; Kessler, Vadim G.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 33
• Pages of publication: 7774 - 7779
• a: 20.426 ± 0.019 Å
• b: 20.426 ± 0.019 Å
• c: 11.738 ± 0.01 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 4241 ± 7 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.1465
• Residual factor for significantly intense reflections: 0.0997
• Weighted residual factors for significantly intense reflections: 0.245
• Weighted residual factors for all reflections included in the refinement: 0.2632
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No