Information card for entry 4323716

Structure parameters

• Common name: [Mn(5-methylpyrazole)2(tp)]n
• Formula: C16 H16 Mn N4 O4
• Calculated formula: C16 H10 Mn N4 O4
• Title of publication: A Magnetically Coupled Three-Dimensional (Terephthalato)manganese(II) Network
• Authors of publication: Chang Seop Hong; Youngkyu Do
• Journal of publication: Inorganic Chemistry
• Year of publication: 1997
• Journal volume: 36
• Pages of publication: 5684 - 5685
• a: 9.8345 ± 0.0011 Å
• b: 10.023 ± 0.002 Å
• c: 10.0181 ± 0.0015 Å
• α: 68.11 ± 0.02°
• β: 71.466 ± 0.011°
• γ: 71.465 ± 0.015°
• Cell volume: 846.2 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0388
• Residual factor for significantly intense reflections: 0.0354
• Weighted residual factors for all reflections: 0.1128
• Weighted residual factors for significantly intense reflections: 0.1098
• Goodness-of-fit parameter for all reflections: 1.123
• Goodness-of-fit parameter for significantly intense reflections: 1.142
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No