Information card for entry 8102439

Structure parameters

• Chemical name: catena-(bis(μ^2^-5-nitro-1,3-benzenedicarboxlato)- hexakis(imidazole)-di-manganese(ii) dihyrate.
• Formula: C34 H34 Mn2 N14 O14
• Calculated formula: C34 H34 Mn2 N14 O14
• Title of publication: Crystal structure of catena-(bis(m2-5-nitro-1,3-benzenedicarboxlato)-hexakis(imidazole)dimanganese(II) dihyrate, Mn2(C3H4N2)6(C8H3NO6)2 · 2H2O
• Authors of publication: Ning Zhao; Zhaoxun Lian; Tianjun Lou; Jiamin Zhang; Xiaobo Li; Ping Liu
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2009
• Journal volume: 224
• Journal issue: 3
• Pages of publication: 463
• a: 13.459 ± 0.003 Å
• b: 16.442 ± 0.004 Å
• c: 18.273 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4043.7 ± 1.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0696
• Residual factor for significantly intense reflections: 0.0528
• Weighted residual factors for significantly intense reflections: 0.1213
• Weighted residual factors for all reflections included in the refinement: 0.132
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No