Information card for entry 7110512

Structure parameters

• Formula: C19 H10 Fe2 O9 S2 W
• Calculated formula: C19 H10 Fe2 O9 S2 W
• Title of publication: Synthesis and structures of heterometallic trinuclear clusters [CpFe(CO)2]2(μ3-S2)W(CO)5 and Cp2Fe2(CO)3(μ-CO)(μ3-S)W(CO)5 and kinetic study of migration of the W(CO)5 moiety in the disulfido complex
• Authors of publication: Kuge, Katsuaki; Tobita, Hiromi; Ogino, Hiroshi
• Journal of publication: Chemical Communications
• Year of publication: 1999
• Journal issue: 12
• Pages of publication: 1061
• a: 17.174 ± 0.006 Å
• b: 7.096 ± 0.004 Å
• c: 19.452 ± 0.004 Å
• α: 90°
• β: 92.26 ± 0.02°
• γ: 90°
• Cell volume: 2368.7 ± 1.6 ų
• Cell temperature: 293.2 K
• Ambient diffraction temperature: 293.2 K
• Number of distinct elements: 6
• 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: 0.03
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for significantly intense reflections: 0.0437
• Weighted residual factors for all reflections included in the refinement: 0.0437
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No