Information card for entry 4301483

Structure parameters

• Formula: C36 H61 Fe4 N3 O12
• Calculated formula: C36 H61 Fe4 N3 O12
• Title of publication: New Findings in the Chemistry of Iron Carbonyls: The Previously Unreported [H4-nFe4(CO)12]n-(n= 1, 2) Series of Clusters, Which Fills the Gap with Ruthenium and Osmium
• Authors of publication: Cristina Femoni; Maria Carmela Iapalucci; Giuliano Longoni; Stefano Zacchini; Salvatore Zarra
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 1599 - 1605
• a: 23.979 ± 0.003 Å
• b: 16.887 ± 0.002 Å
• c: 23.202 ± 0.003 Å
• α: 90°
• β: 113.636 ± 0.002°
• γ: 90°
• Cell volume: 8607.1 ± 1.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1086
• Residual factor for significantly intense reflections: 0.0658
• Weighted residual factors for significantly intense reflections: 0.1731
• Weighted residual factors for all reflections included in the refinement: 0.2059
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No