Information card for entry 4319752

Structure parameters

• Formula: C65 H60 N3 O14 P4 Y
• Calculated formula: C65 H58 N3 O14.01 P4 Y
• Title of publication: Synthesis and Coordination Chemistry of 1,3-Bis(diphenylphosphinomethyl)benzene P,P'-Dioxide
• Authors of publication: Yun-Chou Tan; Xin-Min Gan; Jesse L. Stanchfield; Eileen N. Duesler; R. T. Paine
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 2910 - 2913
• a: 10.525 ± 0.003 Å
• b: 13.132 ± 0.003 Å
• c: 25.184 ± 0.005 Å
• α: 78.99 ± 0.02°
• β: 87.15 ± 0.02°
• γ: 75.48 ± 0.02°
• Cell volume: 3307.6 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1782
• Residual factor for significantly intense reflections: 0.065
• Weighted residual factors for all reflections: 0.1599
• Weighted residual factors for significantly intense reflections: 0.1514
• Goodness-of-fit parameter for all reflections: 1.152
• Goodness-of-fit parameter for significantly intense reflections: 2.081
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No