Information card for entry 7102380

Structure parameters

• Formula: C61 H79 Cl63 N15 P3
• Calculated formula: C61 H79 Cl63 N15 P3
• Title of publication: The N-donor stabilised cyclotriphosphazene hexacation [P3N3(DMAP)6]6+.
• Authors of publication: Boomishankar, Ramamoorthy; Ledger, Joanne; Guilbaud, Jean-Baptiste; Campbell, Neil L; Bacsa, John; Bonar-Law, Richard; Khimyak, Yaroslav Z; Steiner, Alexander
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2007
• Journal issue: 48
• Pages of publication: 5152 - 5154
• a: 20.056 ± 0.008 Å
• b: 26.748 ± 0.01 Å
• c: 25.94 ± 0.01 Å
• α: 90°
• β: 92.836 ± 0.006°
• γ: 90°
• Cell volume: 13899 ± 9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1374
• Residual factor for significantly intense reflections: 0.0958
• Weighted residual factors for significantly intense reflections: 0.2093
• Weighted residual factors for all reflections included in the refinement: 0.2304
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No