Information card for entry 7712143

Structure parameters

• Formula: C100 H112 B2 Cl2 Co2 Fe2 N32 O8
• Calculated formula: C100 H112 B2 Cl2 Co2 Fe2 N32 O8
• 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: 22.8625 ± 0.0014 Å
• b: 17.5476 ± 0.001 Å
• c: 27.2357 ± 0.0018 Å
• α: 90°
• β: 91.011 ± 0.002°
• γ: 90°
• Cell volume: 10924.8 ± 1.2 ų
• Cell temperature: 101 ± 2 K
• Ambient diffraction temperature: 101.58 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1139
• Residual factor for significantly intense reflections: 0.0904
• Weighted residual factors for significantly intense reflections: 0.2364
• Weighted residual factors for all reflections included in the refinement: 0.2573
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No