Information card for entry 7015341

Structure parameters

• Formula: C48 H42 Mn3 N9 O12
• Calculated formula: C48 H42 Mn3 N9 O12
• Title of publication: Structure and magnetic properties of an unprecedented syn-anti μ-nitrito-1κO:2κO' bridged Mn(III)-salen complex and its isoelectronic and isostructural formate analogue.
• Authors of publication: Kar, Paramita; Biswas, Rituparna; Drew, Michael G. B.; Ida, Yumi; Ishida, Takayuki; Ghosh, Ashutosh
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 13
• Pages of publication: 3295 - 3304
• a: 13.767 ± 0.004 Å
• b: 14.3539 ± 0.0016 Å
• c: 13.87 ± 0.002 Å
• α: 108.718 ± 0.013°
• β: 107.147 ± 0.018°
• γ: 103.931 ± 0.015°
• Cell volume: 2303.9 ± 1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.1057
• Residual factor for significantly intense reflections: 0.0478
• Weighted residual factors for significantly intense reflections: 0.0781
• Weighted residual factors for all reflections included in the refinement: 0.0869
• Goodness-of-fit parameter for all reflections included in the refinement: 0.757
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No