Information card for entry 4327624

Structure parameters

• Formula: C14 H6 Fe3 O10 Se
• Calculated formula: C14 H6 Fe3 O10 Se
• Title of publication: Synthesis of an Se-Bridged Triiron Acyl Cluster Complex and the Fischer-Type Carbene Complex Derived from It: Isolation of Rotational Isomers
• Authors of publication: Minghuey Shieh; Horng-Sun Chen; Hsin-Hung Chi; Chuen-Her Ueng
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 5561 - 5564
• a: 9.552 ± 0.003 Å
• b: 16.221 ± 0.002 Å
• c: 12.574 ± 0.003 Å
• α: 90°
• β: 104.91 ± 0.02°
• γ: 90°
• Cell volume: 1882.7 ± 0.8 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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: 0.07
• Residual factor for significantly intense reflections: 0.026
• Weighted residual factors for all reflections: 0.022
• Weighted residual factors for significantly intense reflections: 0.02
• Goodness-of-fit parameter for significantly intense reflections: 1.53
• Diffraction radiation wavelength: 0.7093 Å
• Diffraction radiation type: MolybdenumKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No