Information card for entry 7718658

Structure parameters

• Formula: C157 H158 Cl2 Co Fe N5 O31.92 P7 Ru S4
• Calculated formula: C157 H158 Cl2 Co Fe N5 O31.918 P7 Ru S4
• Title of publication: A water-soluble heterometallic iron(IV)-ruthenium(IV) μ-nitrido porphyrin complex: synthesis, structure and catalytic activity.
• Authors of publication: Ng, Rain; Cheung, Wai-Man; Leung, Cheuk-Pui; Au, Chun Kit; So, Yat-Ming; Sung, Herman H.-Y.; Chan, Wan; Williams, Ian D.; Leung, Wa-Hung
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 23
• Pages of publication: 9359 - 9367
• a: 13.3216 ± 0.0005 Å
• b: 20.9058 ± 0.0007 Å
• c: 28.0045 ± 0.0009 Å
• α: 79.9 ± 0.003°
• β: 80.703 ± 0.003°
• γ: 78.93 ± 0.003°
• Cell volume: 7469.2 ± 0.5 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 10
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1132
• Residual factor for significantly intense reflections: 0.0652
• Weighted residual factors for significantly intense reflections: 0.1514
• Weighted residual factors for all reflections included in the refinement: 0.1797
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No