Information card for entry 7102832

Structure parameters

• Formula: C32 H34 Br3 Mn3 N9 O9
• Calculated formula: C32 H34 Br3 Mn3 N9 O9
• Title of publication: Solvatomagnetic effect and spin-glass behavior in a 1D coordination polymer constructed from EE-azido bridged Mn^III^~3~O units
• Authors of publication: Liu, Cai-Ming; Zhang, De-Qing; Zhu, Dao-Ben
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2008
• Journal issue: 3
• Pages of publication: 368 - 370
• a: 19.1576 ± 0.0012 Å
• b: 8.2244 ± 0.0005 Å
• c: 25.5724 ± 0.0017 Å
• α: 90°
• β: 98.152 ± 0.003°
• γ: 90°
• Cell volume: 3988.5 ± 0.4 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 6
• 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: 0.086
• Residual factor for significantly intense reflections: 0.0651
• Weighted residual factors for significantly intense reflections: 0.1406
• Weighted residual factors for all reflections included in the refinement: 0.1503
• Goodness-of-fit parameter for all reflections included in the refinement: 1.123
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No