Information card for entry 8102759

Structure parameters

• Formula: C30 H44 Cl2 Mn N8 O15
• Calculated formula: C30 H46 Cl2 Mn N8 O16
• Title of publication: Crystal structure of diaquabis{2-[2'-(1'-methylbenzimidazolyl)]-4,4,5,5-tetramethylimidazoline-1-oxyl-3-oxide}mangan(II) bisperchlorate dihydrate, [Mn(H2O)2(C15H19N4O2)2](ClO4)2 · 2H2O
• Authors of publication: Chao-Jun He; Min Wang; Tian-You Yang; Jing Tian
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2010
• Journal volume: 225
• Journal issue: 3
• Pages of publication: 582
• a: 14.227 ± 0.003 Å
• b: 15.892 ± 0.003 Å
• c: 18.547 ± 0.004 Å
• α: 90°
• β: 99.891 ± 0.002°
• γ: 90°
• Cell volume: 4131.1 ± 1.5 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0634
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1579
• Weighted residual factors for all reflections included in the refinement: 0.1678
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No