Information card for entry 7109531

Structure parameters

• Formula: C36 H44 Mn2 N12 Nb O8
• Calculated formula: C36 H32 Mn2 N12 Nb O8
• Title of publication: Natural and magnetic optical activity of 2-D chiral cyanido-bridged MnII-NbIV molecular ferrimagnets
• Authors of publication: Szymon Chorazy; Robert Podgajny; Wojciech Nitek; Tomasz Fic; Edward Gorlich; Michal Rams; Barbara Sieklucka
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 6731
• a: 12.946 ± 0.002 Å
• b: 13.28 ± 0.002 Å
• c: 13.803 ± 0.002 Å
• α: 90°
• β: 112.237 ± 0.002°
• γ: 90°
• Cell volume: 2196.6 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.043
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.0827
• Weighted residual factors for all reflections included in the refinement: 0.1012
• Goodness-of-fit parameter for all reflections included in the refinement: 1.176
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No