Information card for entry 7113105

Structure parameters

• Formula: C32.5 H32.5 Br3 Mn3 N6 O9.5
• Calculated formula: C32.5 H32.5 Br3 Mn3 N6 O9.5
• 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: 7.604 ± 0.002 Å
• b: 33.436 ± 0.007 Å
• c: 15.726 ± 0.003 Å
• α: 90°
• β: 91.95 ± 0.03°
• γ: 90°
• Cell volume: 3996 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1299
• Residual factor for significantly intense reflections: 0.0947
• Weighted residual factors for significantly intense reflections: 0.1878
• Weighted residual factors for all reflections included in the refinement: 0.2017
• Goodness-of-fit parameter for all reflections included in the refinement: 1.174
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7102834
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No