Information card for entry 7701611

Structure parameters

• Formula: C28 H11 Cl0 Mn3 N O20
• Calculated formula: C28 H11 Mn3 N O20
• Title of publication: Structural variation of transition metal-organic frameworks using deep eutectic solvents with different hydrogen bond donors.
• Authors of publication: Zhao, Ming-Yu; Zhu, Jian-Nan; Li, Peng; Li, Wei; Cai, Ting; Cheng, Fang-Fang; Xiong, Wei-Wei
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 27
• Pages of publication: 10199 - 10209
• a: 9.7273 ± 0.0011 Å
• b: 12.8613 ± 0.0014 Å
• c: 14.2241 ± 0.0017 Å
• α: 90°
• β: 109.652 ± 0.013°
• γ: 90°
• Cell volume: 1675.9 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.1237
• Residual factor for significantly intense reflections: 0.083
• Weighted residual factors for significantly intense reflections: 0.1881
• Weighted residual factors for all reflections included in the refinement: 0.2109
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No