Information card for entry 2009449

Structure parameters

• Formula: C34 H32 Fe O4 P2
• Calculated formula: C34 H32 Fe O4 P2
• Title of publication: 1,1'-Bis(diphenylphosphine oxide)ferrocene dihydrate
• Authors of publication: Munyejabo, V.; Postel, M.; Roustan, J.L.; Bensimon, C.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 2
• Pages of publication: 224 - 226
• a: 8.792 ± 0.004 Å
• b: 15.822 ± 0.003 Å
• c: 10.979 ± 0.003 Å
• α: 90°
• β: 106.23 ± 0.02°
• γ: 90°
• Cell volume: 1466.4 ± 0.8 ų
• Cell temperature: 153 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.023
• Goodness-of-fit parameter for significantly intense reflections: 3.15
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No