Information card for entry 4318480

Structure parameters

• Common name: [FeMn(BPBPMP)(OAc)2]ClO4 1/3H2O
• Chemical name: {2-[bis(2-pyridylmethyl)-aminomethyl]-6-[(2-hydroxybenzyl)(2-pyridylmethyl) -aminomethyl]-4-methylphenolate}iron(III)manganese(II) diacetate perchlorate hydrate
• Formula: C38 H39.6 Cl Fe Mn N5 O10.3
• Calculated formula: C38 H39 Cl Fe Mn N5 O10.3
• Title of publication: Synthesis, Structure, Properties, and Phosphatase-Like Activity of the First Heterodinuclear FeIIIMnII Complex with the Unsymmetric Ligand H2BPBPMP as a Model for the PAP in Sweet Potato
• Authors of publication: Peter Karsten; Ademir Neves; Adailton J. Bortoluzzi; Mauricio Lanznaster; Valderes Drago
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 4624 - 4626
• a: 19.513 ± 0.003 Å
• b: 10.75 ± 0.0018 Å
• c: 20.908 ± 0.007 Å
• α: 90°
• β: 117.194 ± 0.014°
• γ: 90°
• Cell volume: 3901 ± 1.7 ų
• Cell temperature: 208 ± 2 K
• Ambient diffraction temperature: 208 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0758
• Residual factor for significantly intense reflections: 0.0443
• Weighted residual factors for significantly intense reflections: 0.1125
• Weighted residual factors for all reflections included in the refinement: 0.1255
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No