Information card for entry 4346259

Structure parameters

• Formula: C120 H80 Mn8 N8 O24 S8
• Calculated formula: C120 H80 Mn8 N8 O24 S8
• Title of publication: Self-assembly of Thiolato-Bridged Manganese(I)-Based Metallarectangles: One-pot Synthesis and Structural Characterization.
• Authors of publication: Ashok Kumar, Chowan; Nagarajaprakash, R.; Ramakrishna, Buthanapalli; Manimaran, Bala
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 17
• Pages of publication: 8406 - 8414
• a: 18.8413 ± 0.0005 Å
• b: 17.2727 ± 0.0006 Å
• c: 19.2668 ± 0.0006 Å
• α: 90°
• β: 104.174 ± 0.003°
• γ: 90°
• Cell volume: 6079.3 ± 0.3 ų
• Cell temperature: 120.05 ± 0.1 K
• Ambient diffraction temperature: 120.05 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.1234
• Residual factor for significantly intense reflections: 0.0628
• Weighted residual factors for significantly intense reflections: 0.131
• Weighted residual factors for all reflections included in the refinement: 0.1679
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No