Information card for entry 4350595

Structure parameters

• Formula: C49 H42 Cl2 N2 O P4 Se2
• Calculated formula: C49 H42 Cl2 N2 O P4 Se2
• Title of publication: Synthesis, spectroscopic, and structural investigation of the cyclic [N(PR2E)2]+ cations (E = Se, Te; R = iPr, Ph): the effect of anion and R-group exchange.
• Authors of publication: Konu, Jari; Chivers, Tristram; Tuononen, Heikki M.
• Journal of publication: Inorganic chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 26
• Pages of publication: 10678 - 10687
• a: 10.765 ± 0.002 Å
• b: 20.093 ± 0.004 Å
• c: 21.546 ± 0.004 Å
• α: 90°
• β: 92.34 ± 0.03°
• γ: 90°
• Cell volume: 4656.5 ± 1.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.054
• Residual factor for significantly intense reflections: 0.0376
• Weighted residual factors for significantly intense reflections: 0.0786
• Weighted residual factors for all reflections included in the refinement: 0.085
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No