Information card for entry 7025124

Structure parameters

• Formula: C16 H24 Mn O12
• Calculated formula: C16 H24 Mn O12
• Title of publication: Ferromagnetic interactions through triple hydrogen bonds in the coordination polymers of alpha,alpha'-dihydroxy-bibenzyl-4,4'-dicarboxylate.
• Authors of publication: Ma, Yu; Cheng, Ai-Ling; Gao, En-Qing
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 14
• Pages of publication: 3521 - 3526
• a: 13.742 ± 0.0004 Å
• b: 14.5235 ± 0.0004 Å
• c: 10.3594 ± 0.0003 Å
• α: 90°
• β: 109.037 ± 0.001°
• γ: 90°
• Cell volume: 1954.47 ± 0.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0246
• Residual factor for significantly intense reflections: 0.0228
• Weighted residual factors for significantly intense reflections: 0.0626
• Weighted residual factors for all reflections included in the refinement: 0.0647
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No