Information card for entry 8106734

Structure parameters

• Formula: C46 H38 Mn N3 O8
• Calculated formula: C46 H38 Mn N3 O8
• Title of publication: Crystal structure of triethylammonium bis{3-(((3-oxidonaphthalen-1-yl)methylene)amino)-2-oxo-2H-chromen-4-olato-κ3 O,N,O′}manganese(III), C46H38MnN3O8
• Authors of publication: Li, Jing; Jia, Hao-Ran; Sun, Yin-Xia
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2017
• Journal volume: 232
• Journal issue: 6
• Pages of publication: 961 - 963
• a: 8.9705 ± 0.0006 Å
• b: 12.0309 ± 0.0008 Å
• c: 18.4209 ± 0.0013 Å
• α: 96.303 ± 0.002°
• β: 103.884 ± 0.002°
• γ: 101.636 ± 0.002°
• Cell volume: 1864 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.072
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1162
• Weighted residual factors for all reflections included in the refinement: 0.1274
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No