Information card for entry 7715514

Structure parameters

• Formula: C156 H248 B4 Co2 Fe4 N48 O22
• Calculated formula: C156 H248 B4 Co2 Fe4 N48 O22
• Title of publication: Reversible structural change of [Co₂Fe₂] complexes between diamagnetic hydrogen-bonded 1D chains and paramagnetic complexes within a layered structure of amphiphilic anions.
• Authors of publication: Mihara, Nozomi; Iitsuka, Soyoka; Shiga, Takuya; Nihei, Masayuki
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 16
• Pages of publication: 7190 - 7196
• a: 12.484 ± 0.003 Å
• b: 16.445 ± 0.004 Å
• c: 22.402 ± 0.005 Å
• α: 95.341 ± 0.004°
• β: 92.874 ± 0.003°
• γ: 94.153 ± 0.004°
• Cell volume: 4559.6 ± 1.9 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0874
• Residual factor for significantly intense reflections: 0.0537
• Weighted residual factors for significantly intense reflections: 0.1189
• Weighted residual factors for all reflections included in the refinement: 0.1361
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No