Information card for entry 7006462

Structure parameters

• Common name: catena-((1,2-bis(4-pyridyl)ethane,N,N')-squarate-bis(aquo)- manganese(ii)) (1,2-bis(4-pyridyl)ethane) hydrated
• Chemical name: catena-[(1,2-bis(4-pyridyl)ethane,N,N')-squarate-bis(aquo)-manganese(II)] (1,2-bis(4-pyridyl)ethane) hydrated
• Formula: C28 H30 Mn N4 O7
• Calculated formula: C28 H28 Mn N4 O7
• Title of publication: Structural diversity in manganese squarate frameworks using N,N-donor chelating/bridging ligands: syntheses, crystal structures and magnetic properties.
• Authors of publication: Ghosh, Ananta Kumar; Ghoshal, Debajyoti; Zangrando, Ennio; Ribas, Joan; Chaudhuri, Nirmalendu Ray
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 12
• Pages of publication: 1554 - 1563
• a: 8.348 ± 0.002 Å
• b: 12.416 ± 0.002 Å
• c: 13.915 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1442.3 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0517
• Residual factor for significantly intense reflections: 0.0439
• Weighted residual factors for significantly intense reflections: 0.1045
• Weighted residual factors for all reflections included in the refinement: 0.1149
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No