Information card for entry 2001200

Structure parameters

• Formula: C38 H33 Fe O2 P2
• Calculated formula: C38 H33 Fe O2 P2
• Title of publication: Structure of (<i>R</i>)-1-[(<i>S</i>)-1',2-bis(diphenylphosphino)ferrocenyl]ethyl acetate
• Authors of publication: Shawkataly, O. B.; Khalil, H.; Fun, H.-K.; Chinnakali, K.; Teoh, S.-G.; Ito, Y.; Sawamura, M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 11
• Pages of publication: 1898 - 1900
• a: 8.684 ± 0.002 Å
• b: 10.1 ± 0.002 Å
• c: 10.109 ± 0.003 Å
• α: 71.55 ± 0.02°
• β: 85.42 ± 0.02°
• γ: 73.97 ± 0.02°
• Cell volume: 808.3 ± 0.4 ų
• Cell temperature: 298 K
• Number of distinct elements: 5
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for significantly intense reflections: 0.0483
• Weighted residual factors for significantly intense reflections: 0.0384
• Goodness-of-fit parameter for significantly intense reflections: 0.87
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No