Information card for entry 4020054

Structure parameters

• Formula: C16 H19 P Se2
• Calculated formula: C16 H19 P Se2
• Authors of publication: Tsutomu Kimura; Toshiaki Murai
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 952 - 959
• a: 7.51 ± 0.001 Å
• b: 13.032 ± 0.002 Å
• c: 17.576 ± 0.002 Å
• α: 90°
• β: 99.495 ± 0.008°
• γ: 90°
• Cell volume: 1696.5 ± 0.4 ų
• Cell temperature: 296.2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.0398
• Weighted residual factors for all reflections included in the refinement: 0.0682
• Goodness-of-fit parameter for all reflections included in the refinement: 0.81
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No