Information card for entry 4105378

Structure parameters

• Formula: C37 H33 Al2 As2 Cl8 P
• Calculated formula: C37 H33 Al2 As2 Cl8 P
• SMILES: [As+]([P]([As+](c1ccccc1)(c1ccccc1)c1ccccc1)C)(c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-][Al](Cl)(Cl)Cl.[Cl-][Al](Cl)(Cl)Cl
• Title of publication: Phosphinopnictonium Cations: High Yield and General Preparative Procedures for New Interpnictogen Frameworks Exploiting As→P and Sb→P Coordinate Bonds
• Authors of publication: Eamonn Conrad; Neil Burford; Robert McDonald; Michael J. Ferguson
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 17000 - 17008
• a: 20.132 ± 0.003 Å
• b: 14.311 ± 0.0018 Å
• c: 15.4865 ± 0.0019 Å
• α: 90°
• β: 101.167 ± 0.0018°
• γ: 90°
• Cell volume: 4377.3 ± 1 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 6
• 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: 0.0505
• Residual factor for significantly intense reflections: 0.0376
• Weighted residual factors for significantly intense reflections: 0.0898
• Weighted residual factors for all reflections included in the refinement: 0.0978
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No