Information card for entry 4306104

Structure parameters

• Common name: Mn3(C8N36O6H18)
• Chemical name: Mn3(C8N36O6H18)
• Formula: C8 H18 Mn3 N36 O6
• Calculated formula: C8 H18 Mn3 N36 O6
• Title of publication: Novel 3-D PtS-like Tetrazolate-Bridged Manganese(II) Complex Exhibiting Spin-Canted Antiferromagnetism and Field-Induced Spin-Flop Transition
• Authors of publication: Ying-Bing Lu; Ming-Sheng Wang; Wei-Wei Zhou; Gang Xu; Guo-Cong Guo; Jin-Shun Huang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 8935 - 8942
• a: 9.286 ± 0.003 Å
• b: 11.406 ± 0.004 Å
• c: 25.703 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2722.4 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 72
• Hermann-Mauguin space group symbol: I b a m
• Hall space group symbol: -I 2 2c
• Residual factor for all reflections: 0.0305
• Residual factor for significantly intense reflections: 0.0303
• Weighted residual factors for significantly intense reflections: 0.1369
• Weighted residual factors for all reflections included in the refinement: 0.138
• Goodness-of-fit parameter for all reflections included in the refinement: 0.981
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No