Information card for entry 4337797

Structure parameters

• Formula: C97 H74 Cl2 Dy F9 N2 O6 P4 Ru S3
• Calculated formula: C97 H74 Cl2 Dy F9 N2 O6 P4 Ru S3
• Title of publication: Redox modulation of magnetic slow relaxation in a 4f-based single-molecule magnet with a 4d carbon-rich ligand.
• Authors of publication: Norel, Lucie; Feng, Min; Bernot, Kevin; Roisnel, Thierry; Guizouarn, Thierry; Costuas, Karine; Rigaut, Stéphane
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 5
• Pages of publication: 2361 - 2363
• a: 12.9524 ± 0.0011 Å
• b: 18.3368 ± 0.0014 Å
• c: 21.6831 ± 0.0017 Å
• α: 67.014 ± 0.003°
• β: 73.618 ± 0.003°
• γ: 77.208 ± 0.003°
• Cell volume: 4512.2 ± 0.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 10
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0731
• Residual factor for significantly intense reflections: 0.0467
• Weighted residual factors for significantly intense reflections: 0.0964
• Weighted residual factors for all reflections included in the refinement: 0.1045
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No