Information card for entry 4347101

Structure parameters

• Formula: C24 H20 P2 Se
• Calculated formula: C24 H20 P2 Se
• SMILES: c1(ccccc1)P(c1ccccc1)(P(c1ccccc1)c1ccccc1)=[Se]
• Title of publication: Condensation Reactions of Chlorophosphanes with Chalcogenides.
• Authors of publication: Yogendra, Sivathmeehan; Chitnis, Saurabh S.; Hennersdorf, Felix; Bodensteiner, Michael; Fischer, Roland; Burford, Neil; Weigand, Jan J.
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 4
• Pages of publication: 1854 - 1860
• a: 9.2358 ± 0.0006 Å
• b: 13.6734 ± 0.0009 Å
• c: 16.3139 ± 0.001 Å
• α: 90°
• β: 91.974 ± 0.002°
• γ: 90°
• Cell volume: 2059 ± 0.2 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0347
• Residual factor for significantly intense reflections: 0.0291
• Weighted residual factors for significantly intense reflections: 0.0763
• Weighted residual factors for all reflections included in the refinement: 0.0855
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No