Information card for entry 8105312

Structure parameters

• Common name: catena-tris(2-oxo)-1'10-phenanthroline-hydrate-molybdenum(vi)- manganese(ii) solvate hydrate
• Formula: C12 H12 Mn Mo N2 O6
• Calculated formula: C12 H12 Mn Mo N2 O6
• Title of publication: Redetermination of the crystal structure of catena-poly[aqua-(1,10-phenanthroline-κ2 N,N′)-(μ2-tetraoxidomolybdato(VI)-κ2 O:O′)manganese(II) monohydrate, C12H12N2O6MoMn
• Authors of publication: Wu-Hua, Chen; Ji, Zhou; Yu-Fan, Wang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2020
• Journal volume: 235
• Journal issue: 4
• Pages of publication: 865 - 866
• a: 7.0427 ± 0.0003 Å
• b: 10.4459 ± 0.0007 Å
• c: 10.5778 ± 0.0006 Å
• α: 73.233 ± 0.006°
• β: 83.372 ± 0.004°
• γ: 77.34 ± 0.004°
• Cell volume: 725.85 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0441
• Residual factor for significantly intense reflections: 0.0386
• Weighted residual factors for significantly intense reflections: 0.0882
• Weighted residual factors for all reflections included in the refinement: 0.0916
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No