Information card for entry 7705916

Structure parameters

• Formula: C51 H60 F18 Mn2 N10 O16
• Calculated formula: C51 H60 F18 Mn2 N10 O16
• Title of publication: A black-box approach to the construction of metal-radical multispin systems and analysis of their magnetic properties.
• Authors of publication: Kadilenko, E. M.; Gritsan, N. P.; Tretyakov, E. V.; Fokin, S. V.; Romanenko, G. V.; Bogomyakov, A. S.; Gorbunov, D. E.; Schollmeyer, D.; Baumgarten, M.; Ovcharenko, V. I.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 46
• Pages of publication: 16916 - 16927
• a: 13.1606 ± 0.0005 Å
• b: 17.1459 ± 0.0006 Å
• c: 30.5349 ± 0.0012 Å
• α: 90°
• β: 101.112 ± 0.002°
• γ: 90°
• Cell volume: 6761 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0714
• Residual factor for significantly intense reflections: 0.0581
• Weighted residual factors for significantly intense reflections: 0.1625
• Weighted residual factors for all reflections included in the refinement: 0.1702
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No