Information card for entry 4339601

Structure parameters

• Formula: C10 H20 Mn2 N2 O12
• Calculated formula: C10 H6 Mn2 N1.98 O12
• Title of publication: [CH3NH2(CH2)2NH2CH3][M2(HCOO)6] (M = MnII and CoII): weak ferromagnetic metal formate frameworks of unique binodal 6-connected (4(12).6(3))(4(9).6(6)) topology, templated by a diammonium cation.
• Authors of publication: Wang, Zheming; Zhang, Xueyu; Batten, Stuart R.; Kurmoo, Mohamedally; Gao, Song
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 21
• Pages of publication: 8439 - 8441
• a: 8.3176 ± 0.0004 Å
• b: 8.3176 ± 0.0004 Å
• c: 15.0651 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 902.61 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 163
• Hermann-Mauguin space group symbol: P -3 1 c
• Hall space group symbol: -P 3 2c
• Residual factor for all reflections: 0.0557
• Residual factor for significantly intense reflections: 0.0318
• Weighted residual factors for significantly intense reflections: 0.0818
• Weighted residual factors for all reflections included in the refinement: 0.0888
• Goodness-of-fit parameter for all reflections included in the refinement: 0.971
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No