Information card for entry 7035405

Structure parameters

• Formula: C8 H14 Cu Fe N O12
• Calculated formula: C8 H6 Cu Fe N O12
• Title of publication: Synthesis and characterization of novel niccolites [(CH3)2NH2][Fe(III)M(II)(HCOO)6] (M(II) = Zn, Ni, Cu).
• Authors of publication: Ciupa, Aneta; Mączka, Mirosław; Gągor, Anna; Pikul, Adam; Ptak, Maciej
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 29
• Pages of publication: 13234 - 13241
• a: 8.3771 ± 0.0008 Å
• b: 14.095 ± 0.0014 Å
• c: 13.6352 ± 0.0015 Å
• α: 90°
• β: 92.975 ± 0.006°
• γ: 90°
• Cell volume: 1607.8 ± 0.3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1415
• Residual factor for significantly intense reflections: 0.1131
• Weighted residual factors for all reflections: 0.1196
• Weighted residual factors for significantly intense reflections: 0.115
• Goodness-of-fit parameter for all reflections: 3.46
• Method of determination: powder diffraction
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.5418 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No