Information card for entry 7712145

Structure parameters

• Formula: C100 H118 B2 Cl2 Co2 Fe2 N32 O10
• Calculated formula: C100 H118 B2 Cl2 Co2 Fe2 N32 O10
• Title of publication: Thermo- and photo-induced electron transfer in a series of [Fe₂Co₂] capsules.
• Authors of publication: Meng, Lingyi; Deng, Yi-Fei; Holmes, Stephen M.; Zhang, Yuan-Zhu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• Journal volume: 52
• Journal issue: 6
• Pages of publication: 1616 - 1622
• a: 21.745 ± 0.003 Å
• b: 14.6648 ± 0.0016 Å
• c: 21.799 ± 0.002 Å
• α: 90°
• β: 109.157 ± 0.004°
• γ: 90°
• Cell volume: 6566.4 ± 1.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 99.99 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1274
• Residual factor for significantly intense reflections: 0.0869
• Weighted residual factors for significantly intense reflections: 0.2238
• Weighted residual factors for all reflections included in the refinement: 0.2609
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No