Information card for entry 7001038

Structure parameters

• Formula: C74 H86 B2 Fe3 Li O9
• Calculated formula: C74 H86 B2 Fe3 Li O9
• Title of publication: Electronic communication in oligonuclear ferrocene complexes with anionic four-coordinate boron bridges
• Authors of publication: Kaufmann, Linda; Breunig, Jens-Michael; Vitze, Hannes; Schödel, Frauke; Nowik, Israel; Pichlmaier, Markus; Bolte, Michael; Lerner, Hans-Wolfram; Winter, Rainer F.; Herber, Rolfe H.; Wagner, Matthias
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 16
• Pages of publication: 2940 - 2950
• a: 17.4879 ± 0.0019 Å
• b: 27.436 ± 0.003 Å
• c: 15.5563 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7463.9 ± 1.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.2222
• Residual factor for significantly intense reflections: 0.1029
• Weighted residual factors for significantly intense reflections: 0.1944
• Weighted residual factors for all reflections included in the refinement: 0.2438
• Goodness-of-fit parameter for all reflections included in the refinement: 0.979
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No