Information card for entry 2013120

Structure parameters

• Chemical name: (R)-(6,6'-dihydroxybiphenyl-2,2'-diyl)bis(diphenylphosphine oxide)
• Formula: C37 H32 O5 P2
• Calculated formula: C37 H32 O5 P2
• SMILES: P(=O)(c1cccc(O)c1c1c(O)cccc1P(=O)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.OC
• Title of publication: (<i>R</i>)-(6,6'-Dihydroxybiphenyl-2,2'-diyl)bis(diphenylphosphine oxide) methanol solvate
• Authors of publication: Qiu, Li Qin; Qi, Jian Ying; Ji, Jian Xin; Zhou, Zhong Yuan; Yeug, Chi Hung; Choi, Michael C. K.; Chan, Albert S. C.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 1
• Pages of publication: o33 - o35
• a: 9.9351 ± 0.0016 Å
• b: 11.149 ± 0.0017 Å
• c: 27.977 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3098.9 ± 0.8 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 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: 0.099
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for significantly intense reflections: 0.062
• Weighted residual factors for all reflections included in the refinement: 0.075
• Goodness-of-fit parameter for all reflections included in the refinement: 0.833
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes