Information card for entry 4110945

Structure parameters

• Formula: C27 H38 Cl8 N2 Se Sn
• Calculated formula: C27 H38 Cl8 N2 Se Sn
• Title of publication: Extending the Series: Synthesis and Characterization of a Dicationic N-Heterocyclic Selenium Carbene Analogue
• Authors of publication: Jason L. Dutton; Heikki M. Tuononen; Michael C. Jennings; Paul J. Ragogna
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Pages of publication: 12624 - 12625
• a: 10.4063 ± 0.0006 Å
• b: 16.072 ± 0.0006 Å
• c: 10.7581 ± 0.0006 Å
• α: 90°
• β: 103.644 ± 0.002°
• γ: 90°
• Cell volume: 1748.52 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0697
• Residual factor for significantly intense reflections: 0.0469
• Weighted residual factors for significantly intense reflections: 0.1141
• Weighted residual factors for all reflections included in the refinement: 0.1249
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No