Information card for entry 7224877

Structure parameters

• Formula: C136 H148 Mn5 N10 O32 Si4
• Calculated formula: C136 H148 Mn5 N10 O32 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: 15.2389 ± 0.0006 Å
• b: 15.997 ± 0.0007 Å
• c: 17.4713 ± 0.0007 Å
• α: 64.428 ± 0.004°
• β: 82.624 ± 0.003°
• γ: 68.486 ± 0.004°
• Cell volume: 3571.9 ± 0.3 ų
• Cell temperature: 200.05 ± 0.1 K
• Ambient diffraction temperature: 200.05 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1234
• Residual factor for significantly intense reflections: 0.0792
• Weighted residual factors for significantly intense reflections: 0.1943
• Weighted residual factors for all reflections included in the refinement: 0.2331
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No