Information card for entry 4309537

Structure parameters

• Common name: Mn(dtbp)2(44'-bpy)(H2O)2
• Formula: C36 H56 Mn N4 O10 P2
• Calculated formula: C36 H56 Mn N4 O10 P2
• Title of publication: Non-Interpenetrating Transition Metal Diorganophosphate 2-Dimensional Rectangular Grids from Their 1-Dimensional Wires: Structural Transformations under Mild Conditions
• Authors of publication: Ramasamy Pothiraja; Malaichamy Sathiyendiran; Ray J. Butcher; Ramaswamy Murugavel
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 6314 - 6323
• a: 15.9627 ± 0.0014 Å
• b: 11.7157 ± 0.0012 Å
• c: 23.502 ± 0.002 Å
• α: 90°
• β: 92.783 ± 0.008°
• γ: 90°
• Cell volume: 4390 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0686
• Residual factor for significantly intense reflections: 0.0455
• Weighted residual factors for significantly intense reflections: 0.1301
• Weighted residual factors for all reflections included in the refinement: 0.1369
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No