Information card for entry 7705915

Structure parameters

• Formula: C30 H37 Cl2 F12 Mn N5 O9
• Calculated formula: C30 H37 Cl1.9998 F12 Mn N5 O9
• 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: 11.4322 ± 0.0004 Å
• b: 11.5053 ± 0.0004 Å
• c: 17.7893 ± 0.0006 Å
• α: 71.618 ± 0.002°
• β: 76.511 ± 0.002°
• γ: 75.461 ± 0.002°
• Cell volume: 2118.89 ± 0.13 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0546
• Residual factor for significantly intense reflections: 0.0487
• Weighted residual factors for significantly intense reflections: 0.142
• Weighted residual factors for all reflections included in the refinement: 0.146
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No