Information card for entry 7000188

Structure parameters

• Formula: C31 H29 Cl Mn O5 P Pd
• Calculated formula: C31 H27 Cl Mn O5 P Pd
• Title of publication: First example of an enantiopure planar chiral ligand built on a (η5-cyclohexadienyl)Mn(CO)3 scaffold
• Authors of publication: Cetiner, Derya; Jacques, Béatrice; Payet, Elina; Chavarot-Kerlidou, Murielle; Rose-Munch, Françoise; Rose, Eric; Tranchier, Jean-Philippe; Herson, Patrick
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 1
• Pages of publication: 27 - 29
• a: 31.6307 ± 0.0018 Å
• b: 16.4534 ± 0.0017 Å
• c: 12.6803 ± 0.0013 Å
• α: 90°
• β: 107.395 ± 0.006°
• γ: 90°
• Cell volume: 6297.4 ± 1 ų
• Cell temperature: 250 K
• Ambient diffraction temperature: 250 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1285
• Residual factor for significantly intense reflections: 0.0646
• Weighted residual factors for all reflections: 0.1155
• Weighted residual factors for significantly intense reflections: 0.0734
• Weighted residual factors for all reflections included in the refinement: 0.0703
• Goodness-of-fit parameter for all reflections included in the refinement: 1.4488
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No