Information card for entry 7050414

Structure parameters

• Common name: Compound 2 1.5 CH2Cl2
• Formula: C73 H70 B2 Cl6 Cu2 F8 Fe2 N4 O10 P4
• Calculated formula: C68.5 H64 B Cl3 Cu F6 Fe N4 O7 P4
• Title of publication: Cyclopropanation and Diels‒Alder reactions catalyzed by the first heterobimetallic complexes with bridging phosphinooxazoline ligands
• Authors of publication: Braunstein, Pierre; Clerc, Guislaine; Morise, Xavier
• Journal of publication: New Journal of Chemistry
• Year of publication: 2003
• Journal volume: 27
• Journal issue: 1
• Pages of publication: 68 - 72
• a: 24.4623 ± 0.0007 Å
• b: 14.3872 ± 0.0006 Å
• c: 12.4708 ± 0.0004 Å
• α: 90°
• β: 111.598 ± 0.004°
• γ: 90°
• Cell volume: 4080.9 ± 0.3 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 10
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.066
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for all reflections: 0.062
• Weighted residual factors for all reflections included in the refinement: 0.057
• Goodness-of-fit parameter for all reflections: 1.254
• Goodness-of-fit parameter for all reflections included in the refinement: 1.153
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No