Information card for entry 7032163

Structure parameters

• Formula: C28 H19 F5 Mn O6 P3 S
• Calculated formula: C28 H19 F5 Mn O6 P3 S
• Title of publication: Manganese(i) templates for the construction of benzannulated triphosphamacrocycles.
• Authors of publication: Edwards, Peter G.; Mahon, Mary F.; Newman, Paul D.; Reixach, Elisenda; Zhang, Wenjian
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 41
• Pages of publication: 15646 - 15655
• a: 9.022 ± 0.0001 Å
• b: 13.421 ± 0.0001 Å
• c: 13.626 ± 0.0002 Å
• α: 69.978 ± 0.001°
• β: 80.994 ± 0.001°
• γ: 76.824 ± 0.001°
• Cell volume: 1503.8 ± 0.03 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.064
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.1089
• Weighted residual factors for all reflections included in the refinement: 0.1196
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No