Information card for entry 2311513

Structure parameters

• Chemical name: Nitrosonium tetrafluoridoborate–5,11,17,23-tetramethyl-6,10:12,16:18,22:24,4-tetrakis(phenylphosphonato-κ^2^<i>O</i>,<i>O</i>)resorcin(4)arene–dichloromethane (1/1/1)
• Formula: C57 H46 B Cl2 F4 N O13 P4
• Calculated formula: C56 H44 B F4 N O13 P4
• Title of publication: Nitro-sonium complexation by the tetra-phospho-nate cavitand 5,11,17,23-tetra-methyl-6,10:12,16:18,22:24,4-tetra-kis-(phenyl-phospho-nato-κ²<i>O</i>,<i>O</i>)resorcin(4)arene.
• Authors of publication: Pinalli, Roberta; Massera, Chiara
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2017
• Journal volume: 73
• Journal issue: Pt 12
• Pages of publication: 1801 - 1805
• a: 13.856 ± 0.001 Å
• b: 14.909 ± 0.002 Å
• c: 16.357 ± 0.002 Å
• α: 63.224 ± 0.002°
• β: 73.137 ± 0.002°
• γ: 88.093 ± 0.002°
• Cell volume: 2868.2 ± 0.6 ų
• Cell temperature: 190 ± 2 K
• Ambient diffraction temperature: 190 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.067
• Residual factor for significantly intense reflections: 0.0417
• Weighted residual factors for significantly intense reflections: 0.1188
• Weighted residual factors for all reflections included in the refinement: 0.1276
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No