Information card for entry 7040297

Structure parameters

• Formula: C28 H62 P4
• Calculated formula: C28 H62 P4
• SMILES: P(C(C)(C)C)(C(C)(C)C)CCP(P(C(C)(C)C)CCP(C(C)(C)C)C(C)(C)C)C(C)(C)C
• Title of publication: Synthesis of a sterically bulky diphosphine synthon and Ru(ii) complexes of a cooperative tridentate enamide-diphosphine ligand platform.
• Authors of publication: Annibale, Vincent T.; Ostapowicz, Thomas G.; Westhues, Stefan; Wambach, Truman C.; Fryzuk, Michael D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 40
• Pages of publication: 16011 - 16025
• a: 11.854 ± 0.005 Å
• b: 11.785 ± 0.005 Å
• c: 24.34 ± 0.005 Å
• α: 90 ± 0.005°
• β: 92.241 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 3398 ± 2 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0556
• Residual factor for significantly intense reflections: 0.0394
• Weighted residual factors for significantly intense reflections: 0.0986
• Weighted residual factors for all reflections included in the refinement: 0.1082
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No