Information card for entry 4323754

Structure parameters

• Formula: C43 H42 Fe3 Mn2 N2 O13 P2
• Calculated formula: C43 H42 Fe3 Mn2 N2 O13 P2
• Title of publication: Structures, Bonding, Infrared Spectroscopy, and Two-Electron Reduction Potentials of the Coordinated Metallopnictanes Fe3(CO)9(μ3-EMLn)2 (E = P, As, Sb; MLn= Cr(CO)5, MnCp(CO)2)
• Authors of publication: Boyce E. Collins; Yoshihiro Koide; Cynthia K. Schauer; Peter S. White
• Journal of publication: Inorganic Chemistry
• Year of publication: 1997
• Journal volume: 36
• Pages of publication: 6172 - 6183
• a: 21.417 ± 0.004 Å
• b: 12.6755 ± 0.0019 Å
• c: 19.231 ± 0.004 Å
• α: 90°
• β: 116.55 ± 0.016°
• γ: 90°
• Cell volume: 4670.1 ± 1.6 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 7
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.118
• Residual factor for significantly intense reflections: 0.063
• Weighted residual factors for all reflections: 0.062
• Weighted residual factors for significantly intense reflections: 0.058
• Goodness-of-fit parameter for significantly intense reflections: 1.42
• Diffraction radiation wavelength: 0.7093 Å
• Diffraction radiation type: MolybdenumKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No