Information card for entry 8106664

Structure parameters

• Formula: C25 H18 Mn N4 O4
• Calculated formula: C25 H18 Mn N4 O4
• Title of publication: Crystal structure of poly[μ4-(4-(carboxylatomethyl)benzoato-κ4 O:O′:O′′:O′′′)-(2-(4-(1H-imidazol-1-yl)phenyl)-1H-benzo[d]imidazole-κN)manganese(II)] [Mn(C9H6O4)(C16H12N4)]
• Authors of publication: Yin, Wei-Dong; Li, Gui-Lian
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2017
• Journal volume: 232
• Journal issue: 5
• Pages of publication: 749 - 751
• a: 7.9366 ± 0.0011 Å
• b: 10.2389 ± 0.0015 Å
• c: 26.313 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2138.2 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0613
• Residual factor for significantly intense reflections: 0.0385
• Weighted residual factors for significantly intense reflections: 0.075
• Weighted residual factors for all reflections included in the refinement: 0.0832
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No