Information card for entry 7702040

Structure parameters

• Formula: C44 H84 Cu7 I6 K O6 P6
• Calculated formula: C44 H84 Cu7 I6 K O6 P6
• Title of publication: 1,2,4-Triphospholyl anions - versatile building blocks for the formation of 1D, 2D and 3D assemblies.
• Authors of publication: Heindl, Claudia; Peresypkina, Eugenia V.; Virovets, Alexander V.; Komarov, Vladislav Yu; Scheer, Manfred
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 22
• Pages of publication: 10245 - 10252
• a: 18.0501 ± 0.0003 Å
• b: 13.3882 ± 0.0003 Å
• c: 29.8992 ± 0.0006 Å
• α: 90°
• β: 90.068 ± 0.002°
• γ: 90°
• Cell volume: 7225.4 ± 0.2 ų
• Cell temperature: 122.98 ± 0.17 K
• Ambient diffraction temperature: 122.98 ± 0.17 K
• Number of distinct elements: 7
• 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: 0.1171
• Residual factor for significantly intense reflections: 0.113
• Weighted residual factors for significantly intense reflections: 0.3039
• Weighted residual factors for all reflections included in the refinement: 0.3063
• Goodness-of-fit parameter for all reflections included in the refinement: 1.133
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No