Information card for entry 4326624

Structure parameters

• Formula: C11 H14 Mn N O5
• Calculated formula: C11 H14 Mn N O5
• Title of publication: Synthesis, Structural Analysis, and Magnetic Properties of Ethylmalonate-Manganese(II) Complexes
• Authors of publication: Mariadel Déniz; Jorge Pasán; Jesús Ferrando-Soria; Oscar Fabelo; Laura Cañadillas-Delgado; Consuelo Yuste; Miguel Julve; Joan Cano; Catalina Ruiz-Pérez
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 10765 - 10776
• a: 7.28 ± 0.0015 Å
• b: 23.943 ± 0.005 Å
• c: 7.614 ± 0.0015 Å
• α: 90°
• β: 90.08 ± 0.03°
• γ: 90°
• Cell volume: 1327.2 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0882
• Residual factor for significantly intense reflections: 0.087
• Weighted residual factors for significantly intense reflections: 0.2231
• Weighted residual factors for all reflections included in the refinement: 0.2258
• Goodness-of-fit parameter for all reflections included in the refinement: 1.263
• Diffraction radiation wavelength: 0.7295 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No