Information card for entry 7061396

Structure parameters

• Chemical name: MnL2
• Formula: C40 H43 B Cl Fe Mn N16 O
• Calculated formula: C40 H43 B Cl Fe Mn N16 O
• Title of publication: Heterobimetallic cyanide-bridged FeIII(μ-CN)MII complexes (M = Mn and Cu): synthesis, structure and magnetism
• Authors of publication: Ahmed, Sayeed; Kumar, Akhilesh; Mukhopadhyay, Narottam; Lloret, Francesc; Mukherjee, Rabindranath
• Journal of publication: New Journal of Chemistry
• Year of publication: 2022
• Journal volume: 46
• Journal issue: 16
• Pages of publication: 7711 - 7720
• a: 12.732 ± 0.002 Å
• b: 13.303 ± 0.003 Å
• c: 13.725 ± 0.003 Å
• α: 89.26 ± 0.005°
• β: 77.669 ± 0.005°
• γ: 74.667 ± 0.005°
• Cell volume: 2187.8 ± 0.8 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0589
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.0941
• Weighted residual factors for all reflections included in the refinement: 0.1063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No