Information card for entry 7224878

Structure parameters

• Formula: C116 H130 Mn3 N4 O34 Si4
• Calculated formula: C116 H130 Mn3 N4 O34 Si4
• Title of publication: Metal-Organic Frameworks Based on Tri- and Penta-nuclear Manganese(II) Secondary Building Units Self-assembled by a V-Shaped Silicon-containing Dicarboxylate
• Authors of publication: Vlad, Angelica; Zaltariov, Mirela-Fernanda; Sova, Sergiu; Novitchi, Ghénadie; Train, Cyrille; Cazacu, Maria
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 26.55 ± 0.0011 Å
• b: 17.3564 ± 0.0005 Å
• c: 30.9789 ± 0.0013 Å
• α: 90°
• β: 116.328 ± 0.005°
• γ: 90°
• Cell volume: 12794.7 ± 1 ų
• Cell temperature: 173.05 ± 0.1 K
• Ambient diffraction temperature: 173.05 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1058
• Residual factor for significantly intense reflections: 0.0736
• Weighted residual factors for significantly intense reflections: 0.1799
• Weighted residual factors for all reflections included in the refinement: 0.1994
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No