Information card for entry 4333339

Structure parameters

• Formula: C40 H70 Cl2 O9 P2
• Calculated formula: C40 H70 Cl2 O9 P2
• Title of publication: Interaction of tertiary phosphines with lignin-type, alpha,beta-unsaturated aldehydes in water.
• Authors of publication: Moiseev, Dmitry V.; Patrick, Brian O.; James, Brian R.; Hu, Thomas Q.
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 22
• Pages of publication: 9389 - 9399
• a: 10.81 ± 0.002 Å
• b: 14.866 ± 0.002 Å
• c: 15.253 ± 0.003 Å
• α: 104.99 ± 0.01°
• β: 100.25 ± 0.01°
• γ: 95.15 ± 0.01°
• Cell volume: 2306.1 ± 0.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1263
• Residual factor for significantly intense reflections: 0.0852
• Weighted residual factors for significantly intense reflections: 0.2086
• Weighted residual factors for all reflections included in the refinement: 0.2298
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No