Information card for entry 4346015

Structure parameters

• Formula: C54 H54 Cl2.5 F2 N3 O P3.5
• Calculated formula: C54 H54 Cl2.6 F2 N3 O1.2 P3.6
• Title of publication: A dicationic iminophosphane.
• Authors of publication: Loh, Ying Kai; Gurnani, Chitra; Ganguly, Rakesh; Vidović, Dragoslav
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 7
• Pages of publication: 3087 - 3089
• a: 10.3874 ± 0.0009 Å
• b: 13.6874 ± 0.0014 Å
• c: 18.2792 ± 0.0016 Å
• α: 108.18 ± 0.003°
• β: 91.595 ± 0.003°
• γ: 96.568 ± 0.003°
• Cell volume: 2447.4 ± 0.4 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1635
• Residual factor for significantly intense reflections: 0.0822
• Weighted residual factors for significantly intense reflections: 0.2124
• Weighted residual factors for all reflections included in the refinement: 0.2732
• Goodness-of-fit parameter for all reflections included in the refinement: 0.997
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No