Information card for entry 8102817

Structure parameters

• Chemical name: 1,4-benzenedicarboxylato-manganese(II)- [11-fluoro-dipyrido[3,2-a:2',3'-c]phenazine]
• Formula: C44 H22 F2 Mn N8 O4
• Calculated formula: C44 H20 F2 Mn N8 O4
• Title of publication: Crystal structure of bis(11-fluorodipyrido[3,2-a:2',3'-c]phenazine)-(1,4-benzenedicarboxylato)manganese(II), Mn(C18H9N4F)2(C8H4O4)
• Authors of publication: Li-Ying Han; Hu Zang; Da-Jun Sun
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2010
• Journal volume: 225
• Journal issue: 4
• Pages of publication: 749
• a: 21.0872 ± 0.0017 Å
• b: 8.2089 ± 0.0007 Å
• c: 21.3815 ± 0.0017 Å
• α: 90°
• β: 113.886 ± 0.001°
• γ: 90°
• Cell volume: 3384.2 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.07
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for significantly intense reflections: 0.1034
• Weighted residual factors for all reflections included in the refinement: 0.1139
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No