Information card for entry 7714934

Structure parameters

• Formula: C13 H27 Cl4 Mn2 N O6
• Calculated formula: C13 H27 Cl4 Mn2 N O6
• Title of publication: Supramolecular crystals of Mn(15-crown-5)(MnCl₄)(DMF) with dielectric phase transition, high quantum yield and phase transition-induced luminescence enhancement behavior.
• Authors of publication: Yuan, Guo-Jun; Pan, Xue-Wei; Chen, Li; Chen, Chao; Ren, Xiao-Ming
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 6
• Pages of publication: 2687 - 2695
• a: 10.4466 ± 0.0004 Å
• b: 14.3125 ± 0.0006 Å
• c: 14.7885 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2211.13 ± 0.16 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 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: 0.0355
• Residual factor for significantly intense reflections: 0.0276
• Weighted residual factors for significantly intense reflections: 0.0508
• Weighted residual factors for all reflections included in the refinement: 0.0545
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No