Information card for entry 7027083

Structure parameters

• Formula: C44 H18 F24 Mn3 N6 O12
• Calculated formula: C44 H20 F24 Mn3 N6 O12
• Title of publication: Complexed bridging ligand, [M(bpca)2] (M = Mn(II) or Fe(II); Hbpca = bis(2-pyridylcarbonyl)amine), as a building block for linear trinuclear complexes
• Authors of publication: Kajiwara, Takashi; Ito, Tasuku
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1998
• Journal issue: 20
• Pages of publication: 3351
• a: 17.142 ± 0.009 Å
• b: 20.552 ± 0.003 Å
• c: 16.233 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5719 ± 3 ų
• Cell temperature: 296.2 K
• Ambient diffraction temperature: 296.2 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.1129
• Residual factor for significantly intense reflections: 0.0585
• Weighted residual factors for all reflections included in the refinement: 0.1882
• Goodness-of-fit parameter for all reflections included in the refinement: 1.141
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No