Information card for entry 7107283

Structure parameters

• Formula: C203 H180 Mn14 N40 O49
• Calculated formula: C203 H172 Mn14 N40 O49
• Title of publication: A molecular [Mn14] coordination cluster featuring two slowly relaxing nanomagnets
• Authors of publication: Jose Sanchez Costa; Leoni A. Barrios; Gavin A. Craig; Simon J. Teat; Fernando Luis; Olivier Roubeau; Marco Evangelisti; Agustin Camon; Guillem Aromi
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 1413
• a: 15.784 ± 0.003 Å
• b: 19.25 ± 0.004 Å
• c: 20.841 ± 0.004 Å
• α: 63.51 ± 0.03°
• β: 87.1 ± 0.03°
• γ: 72.53 ± 0.03°
• Cell volume: 5380 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0786
• Residual factor for significantly intense reflections: 0.0651
• Weighted residual factors for significantly intense reflections: 0.2015
• Weighted residual factors for all reflections included in the refinement: 0.2123
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.7383 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No