Information card for entry 7022506

Structure parameters

• Formula: C18 H20 Mn N4 O6 S2
• Calculated formula: C18 H20 Mn N4 O6 S2
• Title of publication: Ferromagnetic interactions through double hydrogen bonding bridges in manganese(II) coordination polymers.
• Authors of publication: Wang, Kun; Wang, Yan-Qin; Zhang, Xiu-Mei; Gao, En-Qing
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 13
• Pages of publication: 4533 - 4538
• a: 5.5469 ± 0.0018 Å
• b: 10.583 ± 0.003 Å
• c: 12.227 ± 0.003 Å
• α: 53.692 ± 0.017°
• β: 69.966 ± 0.011°
• γ: 81.833 ± 0.009°
• Cell volume: 541.6 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0291
• Residual factor for significantly intense reflections: 0.0276
• Weighted residual factors for significantly intense reflections: 0.0746
• Weighted residual factors for all reflections included in the refinement: 0.0755
• Goodness-of-fit parameter for all reflections included in the refinement: 1.126
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No