Information card for entry 4066491

Structure parameters

• Formula: C32 H51 O2 P
• Calculated formula: C32 H51 O2 P
• SMILES: c1(c(c(C(C)(C)C)cc(C(C)(C)C)c1)O)P(c1c(c(C(C)(C)C)cc(C(C)(C)C)c1)O)C(C)(C)C
• Title of publication: Alkali Metal Complexes of atert-Butylphosphine-Bridged Biphenolate Ligand
• Authors of publication: Hsu, Yu-Lin; Liang, Lan-Chang
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 23
• Pages of publication: 6201
• a: 14.0289 ± 0.0008 Å
• b: 14.5112 ± 0.0008 Å
• c: 14.9869 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3051 ± 0.3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1112
• Residual factor for significantly intense reflections: 0.0543
• Weighted residual factors for significantly intense reflections: 0.1046
• Weighted residual factors for all reflections included in the refinement: 0.1278
• Goodness-of-fit parameter for all reflections included in the refinement: 0.921
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No