Information card for entry 7719151

Structure parameters

• Formula: C22 H26 F2 Mn N5 O5
• Calculated formula: C22 H26 F2 Mn N5 O5
• Title of publication: Unveiling the Relationship between Counterion Size and Spin Crossover Dynamics in Hexadentate Schiff-Base Manganese(III) Complexes
• Authors of publication: Shang, Meng-Jia; Chen, Duyong; Zhou, Ren-He; Lu, Han-Han; Ma, Lin; Xiao, Jingyi; Zhao, Liang; Meng, Yin-Shan; Liu, Tao
• Journal of publication: Dalton Transactions
• Year of publication: 2025
• a: 8.202 ± 0.002 Å
• b: 16.36 ± 0.005 Å
• c: 18.422 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2472 ± 1.2 ų
• Cell temperature: 400 ± 2 K
• Ambient diffraction temperature: 400 ± 2 K
• Number of distinct elements: 6
• 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: 0.0583
• Residual factor for significantly intense reflections: 0.0417
• Weighted residual factors for significantly intense reflections: 0.1106
• Weighted residual factors for all reflections included in the refinement: 0.1245
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No