Information card for entry 4103677

Structure parameters

• Formula: C25.25 H26 Cl2 Mn2 N4 O6.38
• Calculated formula: C25.25 H26 Cl2 Mn2 N4 O6.375
• Title of publication: Tripodal Tris-tacn and Tris-dpa Platforms for Assembling Phosphate-Templated Trimetallic Centers
• Authors of publication: Rui Cao; Peter Müller; Stephen J. Lippard
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 17366 - 17369
• a: 8.3253 ± 0.0003 Å
• b: 9.258 ± 0.0004 Å
• c: 19.6238 ± 0.0008 Å
• α: 86.464 ± 0.001°
• β: 80.668 ± 0.001°
• γ: 70.363 ± 0.001°
• Cell volume: 1405.65 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0353
• Residual factor for significantly intense reflections: 0.0298
• Weighted residual factors for significantly intense reflections: 0.0724
• Weighted residual factors for all reflections included in the refinement: 0.0754
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No