Information card for entry 7719341

Structure parameters

• Formula: C62 H51 Fe Mn2 N12 O11
• Calculated formula: C62 H47 Fe Mn2 N12 O11
• Title of publication: Investigation of protonation induced metal-to-metal electron transfer in a cyano-bridged Mn^III-Fe^III dinuclear complex.
• Authors of publication: Mudoi, Prashurya Pritam; Ahmed, Niku; Choudhury, Anup; Li, Yanling; Lescouëzec, Rodrigue; Kintzel, Benjamin; Akintola, Oluseun; Plass, Winfried; Rajendiran, Marimuthu; Gogoi, Nayanmoni
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 37
• Pages of publication: 14161 - 14172
• a: 12.4237 ± 0.0002 Å
• b: 15.5377 ± 0.0004 Å
• c: 15.3656 ± 0.0003 Å
• α: 90°
• β: 93.822 ± 0.002°
• γ: 90°
• Cell volume: 2959.51 ± 0.11 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1137
• Residual factor for significantly intense reflections: 0.0977
• Weighted residual factors for significantly intense reflections: 0.1738
• Weighted residual factors for all reflections included in the refinement: 0.183
• Goodness-of-fit parameter for all reflections included in the refinement: 1.138
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No