Information card for entry 7125071

Structure parameters

• Formula: C18 H39 N7 O2 P2
• Calculated formula: C18 H39 N7 O2 P2
• Title of publication: Simple access to ionic liquids and organic salts containing the phosphaethynolate (PCO(-)) and Zintl (Sb11(3-)) anions.
• Authors of publication: Jost, Maximilian; Finger, Lars H.; Sundermeyer, Jörg; von Hänisch, Carsten
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 78
• Pages of publication: 11646 - 11648
• a: 11.8762 ± 0.0006 Å
• b: 15.7545 ± 0.0008 Å
• c: 13.6079 ± 0.0006 Å
• α: 90°
• β: 94.012 ± 0.002°
• γ: 90°
• Cell volume: 2539.8 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• 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: 0.045
• Residual factor for significantly intense reflections: 0.0317
• Weighted residual factors for significantly intense reflections: 0.0683
• Weighted residual factors for all reflections included in the refinement: 0.0741
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No