Information card for entry 8106087

Structure parameters

• Formula: C38 H38 Mn2 N2 O14
• Calculated formula: C38 H38 Mn2 N2 O14
• Title of publication: Crystal structure of dimethanol-bis(μ2-methanol-κ2 O:O)-bis{3-((4-methoxy-2-oxidobenzylidene)amino)-2-oxo-2H-chromen-4-olato-κ3 O,N,O′}dimanganese(II), C38H38Mn2N2O14
• Authors of publication: Li, Jing; Jia, Hao-Ran; Sun, Yin-Xia
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2018
• Journal volume: 233
• Journal issue: 2
• Pages of publication: 165 - 167
• a: 8.2828 ± 0.0012 Å
• b: 10.428 ± 0.002 Å
• c: 12.152 ± 0.003 Å
• α: 113.44 ± 0.02°
• β: 93.369 ± 0.016°
• γ: 107.89 ± 0.016°
• Cell volume: 896.5 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0929
• Residual factor for significantly intense reflections: 0.0587
• Weighted residual factors for significantly intense reflections: 0.1043
• Weighted residual factors for all reflections included in the refinement: 0.1288
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No