Information card for entry 7018788

Structure parameters

• Formula: C91 H106 Cl2 Fe4 O2 P4
• Calculated formula: C91 H106 Cl2 Fe4 O2 P4
• Title of publication: Diastereoselective synthesis and coordination chemistry of enantiopure keto-bis-(2-phosphametallocene)s.
• Authors of publication: Carmichael, Duncan; le Goff, Xavier F.; Muller, Eric; Ricard, Louis; Stankevič, Marek
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 17
• Pages of publication: 5155 - 5162
• a: 9.874 ± 0.001 Å
• b: 13.415 ± 0.001 Å
• c: 15.872 ± 0.001 Å
• α: 93.293 ± 0.001°
• β: 101.481 ± 0.001°
• γ: 105.439 ± 0.001°
• Cell volume: 1972.4 ± 0.3 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0472
• Residual factor for significantly intense reflections: 0.0366
• Weighted residual factors for significantly intense reflections: 0.097
• Weighted residual factors for all reflections included in the refinement: 0.1093
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No