Information card for entry 4319951

Structure parameters

• Formula: C6 H16 Mn3 N2 O12 P4
• Calculated formula: C3 H4 Mn3 N2 O12 P4
• Title of publication: Hydrothermal Synthesis and Structural Characterization of the (CnH2n+6N2)[Mn3(HPO3)4] (n= 3-8) New Layered Inorganic-Organic Hybrid Manganese(II) Phosphites. Crystal Structure and Spectroscopic and Magnetic Properties of (C3H12N2)[Mn3(HPO3)4]
• Authors of publication: Sergio Fernández; José L. Pizarro; José L. Mesa; Luis Lezama; María I. Arriortua; Roger Olazcuaga; Teófilo Rojo
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 3476 - 3483
• a: 9.5015 ± 0.001 Å
• b: 5.472 ± 0.001 Å
• c: 14.523 ± 0.004 Å
• α: 90 ± 0.03°
• β: 95.01 ± 0.03°
• γ: 90 ± 0.02°
• Cell volume: 752.2 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0519
• Residual factor for significantly intense reflections: 0.0259
• Weighted residual factors for significantly intense reflections: 0.0517
• Weighted residual factors for all reflections included in the refinement: 0.056
• Goodness-of-fit parameter for all reflections included in the refinement: 0.858
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No